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RCR_SP_70K_SMILES-MMChat

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OpenMol 3

{ "selfies": [ "[F][C][=C][C][=C][Branch2][Ring2][=Branch2][C][=C][N][Branch2][Ring1][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][Ring2][Ring1][Branch2][N][=C][Ring2][Ring1][=C]", "[F][C][=C][C][=C][Branch1][Branch2][C][=C][NH1][C][=N][Ring1][Branch1][N][=C][Ring1][O]" ], "smiles": [ "Fc1ccc(-c2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)nc1", "Fc1ccc(-c2c[nH]cn2)nc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][C][N][Ring1][=Branch1]", "[C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][Cl]", "[C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1]" ], "smiles": [ "C1COCCN1", "Cc1ccc(F)cc1C(=O)Cl", "Cc1ccc(F)cc1C(=O)N1CCOCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][N][Branch1][Ring1][C][C][C][=N][C][=C][Branch2][Ring1][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][=N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]", "[C][C][N][Branch1][Ring1][C][C][C][=N][C][=C][Branch2][Ring1][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][=N][C][C][C][N][C][Ring1][S]" ], "smiles": [ "CCN(CC)c1nc2c(c(-c3ccc(F)cc3)n1)CCCN(C(=O)OC(C)(C)C)C2", "CCN(CC)c1nc2c(c(-c3ccc(F)cc3)n1)CCCNC2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1COCCO1.CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][N][Branch1][Ring1][C][C][C][Branch2][Branch1][#Branch2][C][C][O][C][=C][C][=C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][Branch1][C][C][=C][Ring2][Ring1][=C][C][=Branch1][C][=O][O][C]", "[C][C][N][Branch1][Ring1][C][C][C][Branch2][Branch1][#Branch2][C][C][O][C][=C][C][=C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][Branch1][C][C][=C][Ring2][Ring1][=C][C][=Branch1][C][=O][O]" ], "smiles": [ "CCN(CC)C(CCOc1ccc(C(=O)N2c3ccccc3C(N(C(C)=O)c3ccc(Cl)cc3)CC2C)cc1)C(=O)OC", "CCN(CC)C(CCOc1ccc(C(=O)N2c3ccccc3C(N(C(C)=O)c3ccc(Cl)cc3)CC2C)cc1)C(=O)O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1.CO .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]", "[O][=N+1][Branch1][C][O-1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Br]", "[O][=C][C][=C][C][=C][C][Branch2][Ring1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][P]" ], "smiles": [ "O=Cc1cccc(O)c1", "O=[N+]([O-])c1cc(Cl)ccc1Br", "O=Cc1cccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[Br][C][C][C][C][Ring1][Ring1]", "[O][=C][NH1][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Ring1][=N][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][Ring1][P][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "BrCC1CC1", "O=c1[nH]c2cc(F)c(F)cc2c(=O)n1N(Cc1ccccc1)Cc1ccccc1", "O=c1c2cc(F)c(F)cc2n(CC2CC2)c(=O)n1N(Cc1ccccc1)Cc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][N][C][Ring1][#Branch1]", "[C][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1][Cl]", "[C][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1][N][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=N]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCCC(N)C1", "Cc1ccc[n+]([O-])c1Cl", "Cc1ccc[n+]([O-])c1NC1CCCN(C(=O)OC(C)(C)C)C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CCCCO .", "role": "assistant" } ]

{ "selfies": [ "[N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][Branch1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][Cl][C][=C][Ring2][Ring1][Ring1][N+1][=Branch1][C][=O][O-1]", "[N][C][=C][C][Branch1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][Cl][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][=C][Ring2][Ring1][Ring1][N]" ], "smiles": [ "Nc1nc(-c2cccnc2)c(-c2ccncc2Cl)cc1[N+](=O)[O-]", "Nc1cc(-c2ccncc2Cl)c(-c2cccnc2)nc1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: CCO .", "role": "assistant" } ]

{ "selfies": [ "[F][C][=C][C][=C][Branch1][=C][S][C][C][C][O][C][C][C][C][C][O][Ring1][=Branch1][C][Branch1][C][F][=C][Ring2][Ring1][C]", "[O][C][C][C][S][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]" ], "smiles": [ "Fc1ccc(SCCCOC2CCCCO2)c(F)c1", "OCCCSc1ccc(F)cc1F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][N][=C][Ring1][N][Ring2][Ring1][Ring2]", "[F][C][=C][C][=C][Branch1][=Branch2][N][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring1][N]", "[C][C][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][=Branch1][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N][C][=C][Ring2][Ring1][Ring2][N][=C][Ring2][Ring1][Branch2][Ring2][Ring1][S]" ], "smiles": [ "CCn1cc(C(=O)O)c(=O)c2cc3cc(F)c(Cl)cc3nc21", "Fc1ccc(N2CCNCC2)cc1", "CCn1cc(C(=O)O)c(=O)c2cc3cc(F)c(N4CCN(c5ccc(F)cc5)CC4)cc3nc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][=C][Ring1][#Branch2]", "[C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][S]" ], "smiles": [ "COC(=O)c1ccccc1Oc1cccc(NC(C)=O)c1", "CC(=O)Nc1cccc(Oc2ccccc2C(=O)O)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch2][Ring1][=Branch1][=C][C][=C][N][=C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][C][Ring1][Branch2][=C][Ring1][N][C][=C][C][=C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][=N]", "[C][C][=Branch2][Ring1][=Branch1][=C][C][=C][N][=C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][C][Ring1][Branch2][=C][Ring1][N][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]" ], "smiles": [ "CC(=Cc1cnc2nc(N)nc(N)c2c1)c1ccc(C(=O)OC(C)(C)C)cc1", "CC(=Cc1cnc2nc(N)nc(N)c2c1)c1ccc(C(=O)O)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C[N+](=O)[O-] .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][C][=N][C][Branch2][Ring2][C][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][=C][Ring2][Ring1][C][F][=C][Branch1][N][C][=C][C][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][S][Ring2][Ring1][#C]", "[N][C][C][N][C][C][C][C][Ring1][Branch1][=O]", "[C][C][Branch1][C][C][Branch1][C][C][C][=N][C][Branch2][Ring2][C][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][=C][Ring2][Ring1][C][F][=C][Branch2][Ring1][=Branch1][C][=C][C][=N][C][Branch1][N][N][C][C][N][C][C][C][C][Ring1][Branch1][=O][=N][Ring1][#C][S][Ring2][Ring2][#Branch1]" ], "smiles": [ "CC(C)(C)c1nc(-c2cccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c(-c2ccnc(Cl)n2)s1", "NCCN1CCCC1=O", "CC(C)(C)c1nc(-c2cccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c(-c2ccnc(NCCN3CCCC3=O)n2)s1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be CO.ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][Cl][=C][Ring1][#Branch2]", "[O][=C][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][Br]", "[O][=S][=Branch1][C][=O][Branch1][C][Cl][C][=C][C][=C][C][Branch1][Ring1][C][Br][=C][Ring1][Branch2]" ], "smiles": [ "Cc1cccc(S(=O)(=O)Cl)c1", "O=C1CCC(=O)N1Br", "O=S(=O)(Cl)c1cccc(CBr)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be ClC(Cl)(Cl)Cl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][O][B][Branch1][#C][C][=C][C][Branch1][C][N][=C][C][Branch1][C][F][=C][Ring1][Branch2][O][C][Ring1][=C][Branch1][C][C][C]", "[C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][Ring2][B][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][=C][Ring1][S]" ], "smiles": [ "CC1(C)OB(c2cc(N)cc(F)c2)OC1(C)C", "COCCS(=O)(=O)Cl", "COCCS(=O)(=O)Nc1cc(F)cc(B2OC(C)(C)C(C)(C)O2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][N][Branch1][S][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring1][O]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][N][Branch1][Ring2][C][C][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring1][O]" ], "smiles": [ "COC(=O)CN(CCC(=O)OC(C)(C)C)c1ccc(C(F)(F)F)c(Cl)c1", "CC(C)(C)OC(=O)CCN(CCO)c1ccc(C(F)(F)F)c(Cl)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][I]", "[C][C][=N][C][Branch1][P][N][C][C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][C][Ring1][#Branch2][=C][S][C][Branch1][C][C][=C][Branch1][S][C][=C][Branch1][C][C][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][C][Ring1][#C][=N][Ring2][Ring1][=N]", "[C][C][O][C][=Branch1][C][=O][C][C][C][C][N][Branch2][Ring2][=Branch1][C][=N][C][Branch1][C][C][=N][C][C][Branch1][S][C][=C][Branch1][C][C][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][=C][Branch1][C][C][S][C][Ring2][Ring1][Ring2][=Ring1][#C][C][C][Ring2][Ring1][#Branch2]" ], "smiles": [ "CCI", "Cc1nc(N2CCC(CC(=O)O)CC2)c2sc(C)c(-c3c(C)cc(Br)cc3C)c2n1", "CCOC(=O)CC1CCN(c2nc(C)nc3c(-c4c(C)cc(Br)cc4C)c(C)sc23)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCOC(C)=O.CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][O]", "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][C][=C][Ring1][#Branch1][N][Ring1][#Branch2][C]", "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][C][=C][Ring1][#Branch2][N][Ring1][=N][C]" ], "smiles": [ "CC(=O)O", "CCOC(=O)c1cc2c(N)cccc2n1C", "CCOC(=O)c1cc2c(NC(C)=O)cccc2n1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][N][=C][Branch2][Ring1][#Branch2][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][C][Branch1][C][F][Branch1][C][F][F][O][C][=Ring2][Ring1][Ring2][Ring2][Ring1][=Branch2]", "[O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][N][=C][Branch2][Ring1][#Branch2][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][C][Branch1][C][F][Branch1][C][F][F][O][C][=Ring2][Ring1][Ring2][Ring2][Ring1][=Branch2]" ], "smiles": [ "COc1ccc2c(c1)CCc1nc(-c3onc(-c4ccccc4)c3C(F)(F)F)oc1-2", "Oc1ccc2c(c1)CCc1nc(-c3onc(-c4ccccc4)c3C(F)(F)F)oc1-2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][I]", "[O][=C][Branch1][C][O][C][=C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Br][=C][Ring1][Branch2][O][Ring1][O]", "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Br][=C][Ring1][Branch2][O][Ring1][O]" ], "smiles": [ "CCI", "O=C(O)c1cc2cc(F)cc(Br)c2o1", "CCOC(=O)c1cc2cc(F)cc(Br)c2o1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[Br][C][Branch1][C][Br][Branch1][C][Br][Br]", "[O][C][C][C][C][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N]", "[Br][C][C][C][C][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N]" ], "smiles": [ "BrC(Br)(Br)Br", "OCCCCCc1ccc(-c2ccccc2)cc1", "BrCCCCCc1ccc(-c2ccccc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring2][Branch1][C][C][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring2][=C][C][=C][Ring2][Ring1][#Branch2][C]", "[C][C][=C][C][=C][Branch2][Ring2][Branch1][C][C][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][#Branch2][C][=Branch1][C][=O][O]" ], "smiles": [ "CCOC(=O)c1cc(C2CCCN(C(=O)OCc3ccc(C(F)(F)F)cc3)C2)ccc1C", "Cc1ccc(C2CCCN(C(=O)OCc3ccc(C(F)(F)F)cc3)C2)cc1C(=O)O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be O .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][Branch1][Ring1][C][O][C][O][Ring1][=Branch2]", "[N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][Branch1][Ring1][C][O][C][O][Ring1][=Branch2]" ], "smiles": [ "O=[N+]([O-])c1ccc2c(c1)OC(CO)CO2", "Nc1ccc2c(c1)OC(CO)CO2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][N][Branch1][C][C][C][=C][C][Branch1][P][C][=C][C][=C][N][=C][Branch1][C][N][S][C][Ring1][=Branch1][=C][Ring1][#Branch2][=C][N][=C][Ring1][S][Cl]", "[C][O][C][C][=Branch1][C][=O][Cl]", "[C][O][C][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][N][=C][Branch1][C][Cl][C][Branch1][=Branch1][N][Branch1][C][C][C][=C][Ring1][#Branch2][C][=C][Ring1][S][S][Ring2][Ring1][Ring1]" ], "smiles": [ "CN(C)c1cc(-c2ccc3nc(N)sc3c2)cnc1Cl", "COCC(=O)Cl", "COCC(=O)Nc1nc2ccc(-c3cnc(Cl)c(N(C)C)c3)cc2s1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be ClCCl.c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N]", "[N][C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N]" ], "smiles": [ "CC(C)(C)OC(=O)NC1CC(OCc2ccccc2)C1", "NC1CC(OCc2ccccc2)C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][Cl]", "[N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]" ], "smiles": [ "CC(C)(C)C(=O)Cl", "Nc1ccc(Cl)cc1", "CC(C)(C)C(=O)Nc1ccc(Cl)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "COC(C)(C)C .", "role": "assistant" } ]

{ "selfies": [ "[Cl][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2]", "[Cl][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][C][Ring1][=Branch1]" ], "smiles": [ "Clc1ccc2cc[nH]c2c1", "Clc1ccc2c(c1)NCC2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CC(=O)O.CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][N][C][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]", "[O][=C][Branch1][C][Cl][O][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][C][Branch1][C][C][N][Branch1][#C][C][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CC(C)NCCSc1ccc(Cl)cc1", "O=C(Cl)Oc1ccccc1", "CC(C)N(CCSc1ccc(Cl)cc1)C(=O)Oc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][C][C][C][C][N][Ring1][Branch1]", "[Cl][C][=C][N][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1]", "[C][O][C][C][C][C][C][N][Ring1][Branch1][C][=C][N][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1]" ], "smiles": [ "COCC1CCCN1", "Clc1cncc(Cl)n1", "COCC1CCCN1c1cncc(Cl)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CC(=O)N(C)C .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][=C][C][=C][Branch2][Ring1][S][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][Ring1][P][C][Branch1][O][C][N][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring2][Ring1][=C]", "[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][#Branch2][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][Ring1][P]" ], "smiles": [ "CC(C)(C)OC(=O)Cc1ccc(Oc2ccc(C(=O)Nc3ccc(Cl)c(Cl)c3)cc2)c(CNS(C)(=O)=O)c1", "CS(=O)(=O)NCc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch2][Ring1][Ring1][C][C][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][C]", "[N][C][=C][C][=C][Branch2][Ring1][N][C][C][C][C][=C][C][=C][Branch1][#C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][S][C][=C][Ring2][Ring1][=Branch2]" ], "smiles": [ "O=C(O)c1ccccc1Nc1ccc(CCCc2ccc([N+](=O)[O-])cc2)cc1", "Nc1ccc(CCCc2ccc(Nc3ccccc3C(=O)O)cc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CC#N.CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][=Branch1][=N][O][C][C][O][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][P][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][Ring2][Branch1][Branch1][O]", "[O][=C][Branch2][Ring1][C][N][C][C][C][C][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=C][Branch2][Ring1][#Branch1][O][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Ring1][#Branch2][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=C][Ring2][Ring2][Branch2]" ], "smiles": [ "COC(=O)c1ccc(OCCOc2c(-c3cccc(C(F)(F)F)c3)cc(C(=O)NCCCCCCCCc3ccccc3)cc2-c2cccc(C(F)(F)F)c2)cc1O", "O=C(NCCCCCCCCc1ccccc1)c1cc(-c2cccc(C(F)(F)F)c2)c(OCCOc2ccc(C(=O)O)c(O)c2)c(-c2cccc(C(F)(F)F)c2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][Branch2][I]", "[N][#C][C][=C][C][=C][Branch1][C][I][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2]" ], "smiles": [ "COC(=O)c1cc(C#N)ccc1I", "N#Cc1ccc(I)c(C(=O)O)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][#Branch1][C][=C][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][#N][C][Ring1][=Branch1][=C][N][Ring2][Ring1][Ring1][C][O][C][C][Si][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring2][Ring2]", "[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][#Branch2][C][=C][N][=C][NH1][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][#N][C][Ring1][=Branch1][C][Ring2][Ring1][C][=N][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][N]" ], "smiles": [ "CC(C)NC(=O)c1cccc(-c2cnc3c(n2)c(C(=O)NC(C)C(=O)N2CC(C#N)C2)cn3COCC[Si](C)(C)C)c1", "CC(C)NC(=O)c1cccc(-c2cnc3[nH]cc(C(=O)NC(C)C(=O)N4CC(C#N)C4)c3n2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[N][#C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][N][C][=C][Ring1][#Branch2][F]", "[C][=C][NH1][C][=N][Ring1][Branch1]", "[N][#C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][N][C][=C][Ring1][#Branch2][N][C][=C][N][=C][Ring1][Branch1]" ], "smiles": [ "N#Cc1cc([N+](=O)[O-])c(N)cc1F", "c1c[nH]cn1", "N#Cc1cc([N+](=O)[O-])c(N)cc1-n1ccnc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CN(C)C=O.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=Branch1][Branch2][=N][O][C][Branch1][C][C][C][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1]", "[C][C][Branch1][C][C][O][N][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1]" ], "smiles": [ "CCOC(=O)C(=NOC(C)C)c1csc(N)n1", "CC(C)ON=C(C(=O)O)c1csc(N)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch1][Ring1][C][#N][C][C][Ring1][=Branch2]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch1][Ring1][C][N][C][C][Ring1][=Branch2]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCC(O)(C#N)CC1", "CC(C)(C)OC(=O)N1CCC(O)(CN)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][=C][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=N][Ring1][Branch2][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][C][C][Ring2][Ring1][Ring2][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]", "[C][C][Branch1][=C][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=N][Ring1][Branch2][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][N][C][C][Ring1][=Branch1][C][C][Ring1][=N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]" ], "smiles": [ "CC(Oc1ccc(C#N)cn1)C1CN(C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1c1ccc(Cl)c(Cl)c1", "CC(Oc1ccc(C#N)cn1)C1CN(C(=O)C2CCNCC2)CC1c1ccc(Cl)c(Cl)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][Branch1][Ring1][C][O][C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][Cl][C][=C][Ring1][#Branch2]", "[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][Branch2][Ring1][S][C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1]" ], "smiles": [ "CCCCCCCCCCCCCCCCCCOC(CO)COC(c1ccccc1)(c1ccccc1)c1ccccc1", "Cc1ccc(S(=O)(=O)Cl)cc1", "CCCCCCCCCCCCCCCCCCOC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)COS(=O)(=O)c1ccc(C)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][C][=N][N][Branch2][Ring1][#Branch2][C][C][C][C][=Branch1][C][=O][N][Branch1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][C][Ring1][=C][C][=Ring2][Ring1][Ring2]", "[O][=C][Branch1][C][O][C][C][=N][N][Branch2][Ring1][#Branch2][C][C][C][C][=Branch1][C][=O][N][Branch1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][C][Ring1][=C][C][=Ring2][Ring1][Ring2]" ], "smiles": [ "CCOC(=O)c1cnn(CC2CC(=O)N(c3ccc(F)cc3F)C2)c1", "O=C(O)c1cnn(CC2CC(=O)N(c3ccc(F)cc3F)C2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][=C][C][=C][C][Branch1][Ring1][C][=O][=C][Ring1][Branch2][C][=C][Ring1][=C]", "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C][=C][Ring1][=C]" ], "smiles": [ "COC(=O)c1ccc(-c2cccc(C=O)c2)cc1", "COC(=O)c1ccc(-c2cccc(CO)c2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=N][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1]", "[N][#C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F]", "[C][C][=N][O][C][=C][C][Branch1][#C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][#N][=C][C][=C][Ring2][Ring1][Ring1][Ring1][S]" ], "smiles": [ "Cc1noc2cc(O)ccc12", "N#Cc1cc(F)ccc1F", "Cc1noc2cc(Oc3ccc(F)cc3C#N)ccc12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CC(=O)N(C)C.CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][N][C][C][Branch1][O][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Ring1][O][C][C][Cl]", "[C][O][C][=C][C][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][=C][Ring1][#C]", "[C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][N][C][C][Branch1][O][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Ring1][O][C][C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][Branch2][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CCCCCCCCOC(=O)N1CC(OC(=O)N(C)C)CC1CCCl", "COc1ccc(CCc2ccccc2)c(O)c1", "CCCCCCCCOC(=O)N1CC(OC(=O)N(C)C)CC1CCOc1cc(OC)ccc1CCc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CC(=O)N(C)C .", "role": "assistant" } ]

{ "selfies": [ "[Br][C][=C][C][=C][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch2][C][Ring2][Ring1][Branch2][=C][Ring1][=Branch1][Ring2][Ring1][=Branch1]", "[C][C][Branch1][C][C][O][B][Branch2][Ring1][Ring2][B][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][O][C][Ring1][#C][Branch1][C][C][C]", "[C][C][Branch1][C][C][O][B][Branch2][Ring2][P][C][=C][C][=C][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch2][C][Ring2][Ring1][Branch2][=C][Ring1][=Branch1][Ring2][Ring1][=Branch1][O][C][Ring2][Ring2][C][Branch1][C][C][C]" ], "smiles": [ "Brc1ccc2ccc3c(-c4cccc(-c5ccccc5)c4)ccc4ccc1c2c43", "CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C", "CC1(C)OB(c2ccc3ccc4c(-c5cccc(-c6ccccc6)c5)ccc5ccc2c3c54)OC1(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]", "[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N]" ], "smiles": [ "CC(C)(C)c1ccccc1Oc1ccccc1[N+](=O)[O-]", "CC(C)(C)c1ccccc1Oc1ccccc1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "C1CCOC1.CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][Branch1][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][Branch1][C][C][C][=C][Ring1][O][C][NH1][Ring2][Ring1][C]", "[C][O][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][Ring2][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Branch1][C][C][C][=C][Ring1][#Branch2][C][NH1][Ring1][P]" ], "smiles": [ "COCc1nc(C)c(-c2cc(C(=O)OC)c(C)cc2C)[nH]1", "COCc1nc(C)c(-c2cc(C(=O)O)c(C)cc2C)[nH]1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][O][C][=C][C][=C][Branch1][=Branch2][C][=N][C][C][C][O][Ring1][=Branch1][C][=C][Ring1][N][C][C][Ring2][Ring1][=Branch1]", "[C][=C][C][Branch1][=Branch2][C][=N][C][C][C][O][Ring1][=Branch1][=C][C][=C][Ring1][N][O][C][C][C][C][C][C][N][C][C][Ring1][=Branch1]" ], "smiles": [ "CCOC(=O)N1CCC(CCCOc2ccc(C3=NCCCO3)cc2)CC1", "c1cc(C2=NCCCO2)ccc1OCCCC1CCNCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CC(C)O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][O][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C][Ring1][P][C][Ring2][Ring1][=Branch2]", "[O][=C][Branch1][S][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][N][C][C][O][Ring1][=Branch1][C][C][Ring1][=C]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCOC(C(=O)N2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1", "O=C(Nc1ccc(Cl)c(Cl)c1)N1CCN(C(=O)C2CNCCO2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "ClCCl.O=C(O)C(F)(F)F .", "role": "assistant" } ]

{ "selfies": [ "[Cl][C][C][C][Br]", "[I][C][C][=N][NH1][C][=Ring1][Branch1]", "[Cl][C][C][C][N][C][=C][Branch1][C][I][C][=N][Ring1][=Branch1]" ], "smiles": [ "ClCCCBr", "Ic1cn[nH]c1", "ClCCCn1cc(I)cn1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Branch1][C][Cl][N][=C][C][=C][Ring1][O][Ring1][#Branch1]", "[N][C][=C][C][=C][C][=C][Branch1][C][Cl][N][=C][C][=C][Ring1][O][Ring1][#Branch1]" ], "smiles": [ "O=[N+]([O-])c1cccc2c(Cl)nccc12", "Nc1cccc2c(Cl)nccc12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][C][C][Branch2][Ring1][S][C][O][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][N][Ring2][Ring1][=C]", "[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][Branch2][Ring1][#Branch1][C][O][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][N][C][C][Ring1][=N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring1][#Branch2]" ], "smiles": [ "O=C1CC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CCCN1", "FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNCC2)cc(C(F)(F)F)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCOCC .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][C][C][=C][Branch1][S][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][P]", "[O][=C][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][Br]", "[C][C][C][C][C][=C][Branch2][Ring1][Ring1][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][C]" ], "smiles": [ "CC1CCc2c(cccc2Oc2ccccc2)N1", "O=C1CCC(=O)N1Br", "CC1CCc2c(ccc(Br)c2Oc2ccccc2)N1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][O][B][Branch2][Ring1][Ring2][B][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][O][C][Ring1][#C][Branch1][C][C][C]", "[N][C][=N][N][=C][Branch1][#C][C][=C][C][Branch1][C][O][=C][C][Branch1][C][Br][=C][Ring1][Branch2][O][Ring1][=N]", "[C][C][Branch1][C][C][O][B][Branch2][Ring1][Branch2][C][=C][C][Branch1][C][O][=C][C][Branch1][O][C][=N][N][=C][Branch1][C][N][O][Ring1][=Branch1][=C][Ring1][=N][O][C][Ring2][Ring1][Ring1][Branch1][C][C][C]" ], "smiles": [ "CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C", "Nc1nnc(-c2cc(O)cc(Br)c2)o1", "CC1(C)OB(c2cc(O)cc(-c3nnc(N)o3)c2)OC1(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][I]", "[C][O][C][=C][C][Branch1][Ring1][C][N][=C][C][=Branch2][Ring1][Ring1][=C][Ring1][Branch2][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][=C][Branch2][Ring1][Branch2][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][N][Ring2][Ring1][#C][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][O]", "[C][O][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][#C][S][C][=C][Branch1][S][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][C][N][=C][Ring2][Ring1][Branch1][Ring2][Ring2][=Branch1]" ], "smiles": [ "CI", "COc1cc(CN)c2c(c1CC(=O)OCc1ccccc1)Sc1c(ccc(OC)c1C(=O)OC(C)(C)C)N2C(=O)CCCC(=O)O", "COC(=O)CCCC(=O)N1c2ccc(OC)c(C(=O)OC(C)(C)C)c2Sc2c(CC(=O)OCc3ccccc3)c(OC)cc(CN)c21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCOC(C)=O.CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][C][C][C][Branch1][#C][N][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][S][C][=C][Ring2][Ring1][#Branch1]", "[C][=C][C][NH1][N][=C][C][=Ring1][Branch1][C][=C][Ring1][=Branch2][N][C][C][C][C][N][C][Ring1][=Branch1]" ], "smiles": [ "c1ccc(CN2CCCC(Nc3ccc4[nH]ncc4c3)C2)cc1", "c1cc2[nH]ncc2cc1NC1CCCNC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][N][C][C][N][Ring1][=Branch1]", "[N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N][=N][N][Ring2][Ring1][C][C][=C][C][Branch1][C][Cl][=N][C][=N][Ring1][#Branch1]", "[N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N][=N][N][Ring2][Ring1][C][C][=C][C][Branch1][=Branch2][N][C][C][N][C][C][Ring1][=Branch1][=N][C][=N][Ring1][N]" ], "smiles": [ "C1CNCCN1", "Nc1nc(Nc2ccc(N3CCOCC3)cc2)nn1-c1cc(Cl)ncn1", "Nc1nc(Nc2ccc(N3CCOCC3)cc2)nn1-c1cc(N2CCNCC2)ncn1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1]", "[N][C][C][C][C][C][O]", "[C][C][=C][C][Branch1][Branch2][N][C][C][C][C][C][O][=C][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]" ], "smiles": [ "Cc1cc(F)ccc1[N+](=O)[O-]", "NCCCCCO", "Cc1cc(NCCCCCO)ccc1[N+](=O)[O-]" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][=Branch1][C][O][C][C][O][N][C][Branch1][C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]", "[Cl][C][=N][C][=C][C][=N][Ring1][=Branch1]", "[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][=C][C][O][C][C][O][C][=N][C][=C][C][=N][Ring1][=Branch1][N][C][Branch1][C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Ring2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]" ], "smiles": [ "CCOC(=O)C1=C(COCCO)NC(C)=C(C(=O)OC)C1c1ccccc1Cl", "Clc1ncccn1", "CCOC(=O)C1=C(COCCOc2ncccn2)NC(C)=C(C(=O)OC)C1c1ccccc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][Branch2][Ring1][Ring1][C][C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][=C][Ring2][Ring1][C]", "[C][C][=C][C][=C][Branch1][#C][C][C][O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][N][=C][Ring1][S]" ], "smiles": [ "Cc1ccc(CCOc2ccc([N+](=O)[O-])cc2)nc1", "Cc1ccc(CCOc2ccc(N)cc2)nc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[N][C][=C][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring1][C]", "[N][C][=C][C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][P]" ], "smiles": [ "Nc1cc(C(=O)N2CCOCC2)cc(C(F)(F)F)c1", "Nc1cc(CN2CCOCC2)cc(C(F)(F)F)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][C][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][C]", "[C][O][C][=C][Branch1][C][C][C][=N][C][Branch1][Ring1][C][O][=C][Ring1][=Branch2][C]" ], "smiles": [ "COC(=O)c1ncc(C)c(OC)c1C", "COc1c(C)cnc(CO)c1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][N][C][C][N][C][C][Ring1][=Branch1]", "[O][=C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][C][Cl][=C][Ring1][#Branch2]", "[C][N][C][C][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][C][Cl][=C][Ring1][#Branch2][C][C][Ring1][P]" ], "smiles": [ "CN1CCNCC1", "O=Cc1ccc([N+](=O)[O-])c(Cl)c1", "CN1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be Cc1ccccc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2]", "[C][C][Branch1][C][C][C][C][C][=C][C][Branch2][Ring2][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=C][C][=C][Ring2][Ring1][O][O][Ring2][Ring1][S]" ], "smiles": [ "CC(C)(C)OC(=O)CN(Cc1cccc(-c2ccccc2)c1)S(=O)(=O)c1ccc2c(c1)CCC(C)(C)O2", "CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(-c4ccccc4)c3)ccc2O1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]", "[O][C][C][Br]", "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][Branch1][Branch1][O][C][C][O][=C][Ring1][#Branch2]" ], "smiles": [ "O=[N+]([O-])c1cccc(O)c1", "OCCBr", "O=[N+]([O-])c1cccc(OCCO)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][=C][C][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=C][=C][Ring2][Ring1][Ring2]", "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][N][C][=C][C][C][Branch1][C][N][C][C][Ring1][#Branch1][=C][Ring1][=N]" ], "smiles": [ "CCOC(=O)c1cccc(C2=CCC(NC(=O)OC(C)(C)C)CC2)c1", "CCOC(=O)c1cccc(C2=CCC(N)CC2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: C1COCCO1.Cl .", "role": "assistant" } ]

{ "selfies": [ "[Br][Br]", "[C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Ring1][#Branch2]", "[C][C][=C][C][Branch1][C][O][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][Br]" ], "smiles": [ "BrBr", "Cc1ccc(C(=O)O)c(O)c1", "Cc1cc(O)c(C(=O)O)cc1Br" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch2][Ring1][Branch1][C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][O][C][=Ring1][O][C][S][Ring2][Ring1][Ring1]", "[C][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Ring1][O][C][C][C][=N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][S][Ring1][Branch2]" ], "smiles": [ "COC(=O)c1cnc(CCc2c(-c3ccccn3)noc2C)s1", "Cc1onc(-c2ccccn2)c1CCc1ncc(C(=O)O)s1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "C1CCOC1.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][C][=C][C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][=C][Branch1][C][Cl][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][Ring2][Ring1][#Branch1]", "[O][=C][Branch1][C][O][C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][C][=C][C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][=C][Branch1][C][Cl][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][Ring2][Ring1][#Branch1]" ], "smiles": [ "COC(=O)C(CC1CCC1)c1cc(OCC(F)(F)F)c(Cl)c(-c2ccc(C(F)(F)F)cc2)c1", "O=C(O)C(CC1CCC1)c1cc(OCC(F)(F)F)c(Cl)c(-c2ccc(C(F)(F)F)cc2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][Branch2][Ring1][#C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][S][=C][C][=N][Ring2][Ring1][=Branch1]", "[C][C][=C][C][Branch2][Ring1][O][C][=C][C][Branch1][C][N][=C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=C][=C][C][=N][Ring2][Ring1][Ring2]" ], "smiles": [ "Cc1cc(-c2cc(C(=O)OC(C)(C)C)cc([N+](=O)[O-])c2)ccn1", "Cc1cc(-c2cc(N)cc(C(=O)OC(C)(C)C)c2)ccn1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][#N][=C][Ring1][N]", "[C][C][Branch1][C][C][Branch1][Ring1][C][#N][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=C][Ring1][=Branch2][Cl]" ], "smiles": [ "COC(=O)c1ccc(Cl)c(C(C)(C)C#N)c1", "CC(C)(C#N)c1cc(C(=O)O)ccc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][Branch1][C][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][=C][Ring2][Ring1][Branch1][Ring1][P]", "[N][C][=C][C][=C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][Branch1][C][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][=C][Ring2][Ring1][Branch1][Ring1][P]" ], "smiles": [ "O=[N+]([O-])c1cccc2ccc(-c3cc(F)cc(C(F)(F)F)c3)nc12", "Nc1cccc2ccc(-c3cc(F)cc(C(F)(F)F)c3)nc12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CC(C)O.O .", "role": "assistant" } ]

{ "selfies": [ "[O][=S][=Branch1][C][=O][Branch1][C][Cl][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]", "[O][C][=C][C][Branch1][C][O][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][O]", "[O][=S][=Branch1][C][=O][Branch2][Ring1][Ring1][O][C][=C][C][Branch1][C][O][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]" ], "smiles": [ "O=S(=O)(Cl)c1ccccc1Cl", "Oc1cc(O)c2ccccc2c1", "O=S(=O)(Oc1cc(O)c2ccccc2c1)c1ccccc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][N][=C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=Ring1][#Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][C][Ring1][P][C][C][S][C]", "[C][S][C][C][C][O][C][C][N][C][Ring1][=Branch1][=N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P][=O]" ], "smiles": [ "CCOC(=O)c1nc2n(c(=O)c1OCc1ccccc1)CCOC2CCSC", "CSCCC1OCCn2c1nc(C(=O)O)c(OCc1ccccc1)c2=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "C1CCOC1.O .", "role": "assistant" } ]

{ "selfies": [ "[Br][P][Branch1][C][Br][Br]", "[O][C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[Br][C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "BrP(Br)Br", "OCc1cc(Br)ccc1OCc1ccccc1", "BrCc1cc(Br)ccc1OCc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "CCOCC .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch2][Ring1][=Branch2][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][=C][Ring2][Ring1][#Branch1]", "[C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][N][C][Branch2][Ring1][=Branch2][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][=C][Ring2][Ring1][Branch1]" ], "smiles": [ "CC(C)Oc1ccc([N+](=O)[O-])c(NC2CCN(C(=O)OC(C)(C)C)CC2)c1", "CC(C)Oc1ccc(N)c(NC2CCN(C(=O)OC(C)(C)C)CC2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[N][#C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]", "[N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]" ], "smiles": [ "N#Cc1ccc(F)cc1C(F)(F)F", "NCc1ccc(F)cc1C(F)(F)F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][=C][Branch1][#Branch1][C][=N][N][Ring1][Branch1][C][C][N][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][N][C][Branch1][C][F][=C][Ring1][=Branch2]", "[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][Ring1][S][C][=C][Ring2][Ring1][Branch2][F]" ], "smiles": [ "CCCS(=O)(=O)Cl", "Cc1ccc2c(c1)Nc1c(cnn1C)CN2C(=O)c1ccc(CN)c(F)c1", "CCCS(=O)(=O)NCc1ccc(C(=O)N2Cc3cnn(C)c3Nc3cc(C)ccc32)cc1F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[N][C][=C][C][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][=C][C][=C][Ring1][#C][Cl]", "[O][=C][Branch1][C][Cl][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=C][Branch1][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][=C][C][=C][Ring1][#C][Cl]" ], "smiles": [ "Nc1cc(OCCN2CCOCC2)ccc1Cl", "O=C(Cl)C=Cc1ccccc1", "O=C(C=Cc1ccccc1)Nc1cc(OCCN2CCOCC2)ccc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CC(C)=O.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=N][C][Branch2][Ring1][=Branch1][N][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][=C][Ring2][Ring1][Branch1][N+1][=Branch1][C][=O][O-1]", "[C][C][=C][C][=N][C][Branch2][Ring1][=Branch1][N][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][=C][Ring2][Ring1][Branch1][N]" ], "smiles": [ "Cc1ccnc(Nc2ccc(OCc3ccccc3)cc2)c1[N+](=O)[O-]", "Cc1ccnc(Nc2ccc(OCc3ccccc3)cc2)c1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][=C][C][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=O]", "[N][C][C][C][Ring1][Ring1]", "[C][=C][C][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][N][C][C][C][Ring1][Ring1]" ], "smiles": [ "C=CCCc1cc(F)ccc1C=O", "NC1CC1", "C=CCCc1cc(F)ccc1CNC1CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][C][=C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][C][=C][Ring1][S]", "[O][=S][=Branch1][C][=O][Branch1][C][Cl][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]", "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][P][C][=C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][#Branch2]" ], "smiles": [ "COC(=O)c1ccc(C=Cc2cc(Cl)ccc2N)cc1", "O=S(=O)(Cl)c1ccc(Cl)cc1", "COC(=O)c1ccc(C=Cc2cc(Cl)ccc2NS(=O)(=O)c2ccc(Cl)cc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "ClCCl.c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][=C][C][Br]", "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][O][=C][Ring1][Branch2]", "[C][=C][C][O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][Cl]" ], "smiles": [ "C=CCBr", "O=[N+]([O-])c1ccc(Cl)c(O)c1", "C=CCOc1cc([N+](=O)[O-])ccc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][C][Cl][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=C][N][C][C][Branch1][Ring1][C][O][O][Ring1][#Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][=N][O][C][C][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CC(C)(C)[Si](Cl)(c1ccccc1)c1ccccc1", "O=C1NCC(CO)O1", "CC(C)(C)[Si](OCC1CNC(=O)O1)(c1ccccc1)c1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be CN(C)C=O.O .", "role": "assistant" } ]

{ "selfies": [ "[Br][C][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]", "[O][=C][C][=C][C][=C][Branch1][#C][O][C][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][C]" ], "smiles": [ "BrCCCOCc1ccccc1", "O=Cc1ccc(O)cc1", "O=Cc1ccc(OCCCOCc2ccccc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CN(C)C=O.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][N][C][C][Branch1][C][C][Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][#C][=O]", "[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][N][C][C][Branch1][C][C][Branch1][C][C][N][C][C][Ring1][Branch2][=O]" ], "smiles": [ "Cc1c(F)cccc1N1CC(C)(C)N(C(=O)OC(C)(C)C)CC1=O", "Cc1c(F)cccc1N1CC(C)(C)NCC1=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[N][#C][C][N][C][C][C][C][Branch1][C][O][C][Ring1][#Branch1]", "[N][C][C][N][C][C][C][C][Branch1][C][O][C][Ring1][#Branch1]" ], "smiles": [ "N#CCN1CCCC(O)C1", "NCCN1CCCC(O)C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][N][S][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][NH1][Ring1][=C]", "[O][=C][Branch1][C][O][C][=C][C][Branch1][N][S][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][NH1][Ring1][=C]" ], "smiles": [ "COC(=O)c1cc(SCCc2ccccc2)c[nH]1", "O=C(O)c1cc(SCCc2ccccc2)c[nH]1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][P][O][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][C]", "[O][=C][Branch1][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][P][O][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][C]" ], "smiles": [ "COC(=O)C(=O)c1ccc(OCc2ccc3ccccc3n2)cc1", "O=C(O)C(=O)c1ccc(OCc2ccc3ccccc3n2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be C1CCOC1.CO .", "role": "assistant" } ]

{ "selfies": [ "[F][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2]", "[F][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][C][Ring1][=Branch1]" ], "smiles": [ "Fc1ccc2cc[nH]c2c1", "Fc1ccc2c(c1)NCC2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: CC(=O)O .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring2][S][O][C][C][C][N][Branch2][Ring2][Ring1][C][C][=C][C][=C][Branch2][Ring1][#Branch1][C][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][S][C][C][Ring2][Ring1][#Branch1][C][Branch1][C][Br][=C][Ring2][Ring1][#C]", "[N][C][=C][C][=C][Branch2][Ring2][S][O][C][C][C][N][Branch2][Ring2][Ring1][C][C][=C][C][=C][Branch2][Ring1][#Branch1][C][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][S][C][C][Ring2][Ring1][#Branch1][C][Branch1][C][Br][=C][Ring2][Ring1][#C]" ], "smiles": [ "O=[N+]([O-])c1ccc(OC2CCN(Cc3ccc(C(O)(C(F)(F)F)C(F)(F)F)cc3)CC2)c(Br)c1", "Nc1ccc(OC2CCN(Cc3ccc(C(O)(C(F)(F)F)C(F)(F)F)cc3)CC2)c(Br)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CC(C)O.ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][N][C][C][Branch1][Ring1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N]", "[C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][N][C][C][Branch1][O][C][O][S][Branch1][C][C][=Branch1][C][=O][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]" ], "smiles": [ "CN1CC(CO)Oc2ccccc21", "CS(=O)(=O)Cl", "CN1CC(COS(C)(=O)=O)Oc2ccccc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][O][C][C][O]", "[C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][O][C][C][O][S][Branch1][C][C][=Branch1][C][=O][=O]" ], "smiles": [ "CC(C)(C)OC(=O)NCCOCCO", "CS(=O)(=O)Cl", "CC(C)(C)OC(=O)NCCOCCOS(C)(=O)=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=O]", "[N-1][=N+1][=N][C][=C][C][=C][Branch1][Ring1][C][=O][C][=C][Ring1][Branch2]", "[N-1][=N+1][=N][C][=C][C][=C][Branch1][Branch1][C][=C][C][=O][C][=C][Ring1][#Branch2]" ], "smiles": [ "CC=O", "[N-]=[N+]=Nc1ccc(C=O)cc1", "[N-]=[N+]=Nc1ccc(C=CC=O)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CC(C)O.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=N][C][Branch1][C][C][=C][O][Ring1][=Branch1]", "[C][C][=C][O][C][Branch2][Ring1][Branch1][N][Branch1][=Branch2][C][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][Branch1][C][C][C][=N][Ring1][P]" ], "smiles": [ "CCOC(=O)CCCN(C(=O)C(C)C)c1nc(C)co1", "Cc1coc(N(CCCC(=O)O)C(=O)C(C)C)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][C][C][=C][C][=C][Branch1][=C][O][C][C][C][N][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][P][C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][O][=O]", "[O][=C][Branch1][C][O][C][C][C][C][=C][C][=C][Branch1][=C][O][C][C][C][N][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][P][C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][O][=O]" ], "smiles": [ "COC(=O)CC1Cc2ccc(OCCCNc3ccccn3)cc2CN(CC(F)(F)F)C1=O", "O=C(O)CC1Cc2ccc(OCCCNc3ccccn3)cc2CN(CC(F)(F)F)C1=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][N][C][C][Ring1][=Branch1]", "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][N][N][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "C1CCNCC1", "O=[N+]([O-])c1ccc(Br)cc1Nc1ccccc1", "O=[N+]([O-])c1ccc(N2CCCCC2)cc1Nc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: CN1CCCC1=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][=C][Ring1][S]", "[C][C][Branch1][C][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring1][C][N][C][=C][Ring1][Branch2][C][Ring1][#C][Branch1][C][C][C]" ], "smiles": [ "CC(C)(C)OC(=O)NCc1ccc(NC(=O)C2C(C)(C)C2(C)C)cc1", "CC1(C)C(C(=O)Nc2ccc(CN)cc2)C1(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][N]", "[O][=C][C][C][C][Branch2][Ring1][C][C][=C][C][=C][Branch1][Branch2][O][C][C][C][O][Ring1][Ring1][C][=C][Ring1][O][=N][N][Ring1][P]", "[C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][N][C][=N][N][C][=Branch1][C][=O][C][C][Ring1][#Branch1][C][=C][Ring1][=N]" ], "smiles": [ "CC(C)N", "O=C1CCC(c2ccc(OCC3CO3)cc2)=NN1", "CC(C)NCC(O)COc1ccc(C2=NNC(=O)CC2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: CO .", "role": "assistant" } ]

{ "selfies": [ "[C][N][C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=C][Branch1][=N][C][C][S][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][=C][Ring1][=C][=N][C][=C][C][=C][Branch1][#C][O][C][C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=C][Ring1][S][Ring2][Ring2][Ring1]", "[O][=C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]", "[C][N][C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=C][Branch1][=N][C][C][S][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][=C][Ring1][=C][=N][C][=C][C][=C][Branch2][Ring1][S][O][C][C][C][=C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring1][P][C][=C][Ring2][Ring1][#Branch2][Ring2][Ring2][=N]" ], "smiles": [ "Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccc(OCCc3ccc(N)cc3)cc21", "O=C=Nc1ccc(Cl)cc1", "Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccc(OCCc3ccc(NC(=O)Nc4ccc(Cl)cc4)cc3)cc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][#C][C][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][Ring1][=N][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][C][Ring2][Ring2][C]", "[O][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][Branch1][#C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][=C][C][=C][Branch1][=N][O][C][C][C][N][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring1][S][Ring2][Ring1][P]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCN(CCCOc2ccc3c(c2)C(=O)C(c2cccnc2)=C3c2cc(F)cc(F)c2)CC1", "O=C1C(c2cccnc2)=C(c2cc(F)cc(F)c2)c2ccc(OCCCN3CCNCC3)cc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]