id
int64
0
300k
molecules
dict
ground_truth
stringlengths
7
2.47k
messages
listlengths
3
3
298,499
{ "selfies": "[C][=C][N][=C][S][C][=C][C][=N][C][=C][N][=C][Ring1][=Branch1][N][=C][Ring1][#Branch2][C][Ring1][=N][=C][Ring1][P]", "smiles": "c1cnc2sc3cc4nccnc4nc3c2c1" }
17-thia-4,7,9,15-tetrazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),12,14-octaene
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "17-thia-4,7,9,15-tetrazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),12,14-octaene", "role": "assistant" } ]
298,500
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][Branch1][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Branch2][Branch1][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][C][Ring2][Ring1][S][=Ring2][Ring1][N][=C][Ring2][Branch1][C][C][=C][Ring2][Branch1][Branch2]", "smiles": "c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)c2)cc1" }
3-[9-[2-(3,5-diphenylphenyl)phenyl]dibenzofuran-2-yl]-9-phenylcarbazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "3-[9-[2-(3,5-diphenylphenyl)phenyl]dibenzofuran-2-yl]-9-phenylcarbazole", "role": "assistant" } ]
298,501
{ "selfies": "[C][=C][C][=C][Branch2][=Branch2][=N][C][Branch2][Branch2][=Branch1][C][=C][C][=C][Branch2][#Branch1][#Branch2][N][Branch2][Ring2][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][Ring1][P][C][=C][Ring2][Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][=Branch1][#Branch2][C][=C][Ring2][=Branch1][S]", "smiles": "c1ccc(C2(c3ccc(N(c4cccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)c4)c4cccc5c4-c4ccccc4C54c5ccccc5-c5cc6ccccc6cc54)cc3)c3ccccc3-c3ccccc32)cc1" }
N-[3-(9-phenylfluoren-9-yl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]spiro[benzo[b]fluorene-11,9'-fluorene]-4'-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "N-[3-(9-phenylfluoren-9-yl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]spiro[benzo[b]fluorene-11,9'-fluorene]-4'-amine", "role": "assistant" } ]
298,502
{ "selfies": "[C][=C][C][=C][Branch2][=Branch1][Branch1][C][=C][C][=C][Branch2][Ring2][=Branch1][N][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=C][C][=C][Ring1][=N][Ring2][Ring1][Branch2][C][=C][Ring2][Ring1][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring2][P]", "smiles": "c1ccc(-c2ccc(-n3c4cc5ccccc5cc4c4c5sc6ccccc6c5ccc43)cc2N(c2ccccc2)c2ccccc2)cc1" }
N,N,2-triphenyl-5-(3-thia-14-azahexacyclo[11.11.0.02,10.04,9.015,24.017,22]tetracosa-1(13),2(10),4,6,8,11,15,17,19,21,23-undecaen-14-yl)aniline
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "N,N,2-triphenyl-5-(3-thia-14-azahexacyclo[11.11.0.02,10.04,9.015,24.017,22]tetracosa-1(13),2(10),4,6,8,11,15,17,19,21,23-undecaen-14-yl)aniline", "role": "assistant" } ]
298,503
{ "selfies": "[C][N][C][=N][C][Branch1][N][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][=N][C][=C][Ring1][=N][N][=C][C][Ring1][Branch1][C][O][C][Branch1][N][C][O][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Branch1][N][O][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1][Branch1][C][C][F]", "smiles": "CNc1nc(NC(=O)CC(C)C)nc2c1N=CC2C1OC(COC(=O)C(C)C)C(OC(=O)CC(C)C)C1(C)F" }
[(2R,3R,4S,5S)-4-fluoro-4-methyl-5-[4-(methylamino)-2-(3-methylbutanoylamino)-7H-pyrrolo[3,2-d]pyrimidin-7-yl]-2-(2-methylpropanoyloxymethyl)oxolan-3-yl] 3-methylbutanoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "[(2R,3R,4S,5S)-4-fluoro-4-methyl-5-[4-(methylamino)-2-(3-methylbutanoylamino)-7H-pyrrolo[3,2-d]pyrimidin-7-yl]-2-(2-methylpropanoyloxymethyl)oxolan-3-yl] 3-methylbutanoate", "role": "assistant" } ]
298,507
{ "selfies": "[C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][=C][Ring1][=N][N][C][Ring1][S][=C][Ring2][Ring1][Ring2][B][Ring2][Ring1][=Branch2][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][O][Ring2][Ring1][P]", "smiles": "c1cc2c3c(c1)Oc1ccc4c5cc6oc7ccccc7c6cc5n5c4c1B3c1c(cccc1-5)O2" }
14,22,28-trioxa-4-aza-1-boradecacyclo[21.11.1.02,21.03,18.04,33.05,17.07,15.08,13.027,35.029,34]pentatriaconta-2(21),3(18),5(17),6,8,10,12,15,19,23,25,27(35),29,31,33-pentadecaene
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "14,22,28-trioxa-4-aza-1-boradecacyclo[21.11.1.02,21.03,18.04,33.05,17.07,15.08,13.027,35.029,34]pentatriaconta-2(21),3(18),5(17),6,8,10,12,15,19,23,25,27(35),29,31,33-pentadecaene", "role": "assistant" } ]
298,508
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][B][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][#C][C][=C][Ring2][Ring1][Ring1][N][Ring2][Ring2][Ring1][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2][Ring2][Ring2][C]", "smiles": "CC(C)(C)c1ccc2c(c1)B1c3ccccc3Oc3ccc4c5cc6c7ccccc7n(-c7ccccc7)c6cc5n-2c4c31" }
29-tert-butyl-5-phenyl-19-oxa-1,5-diaza-26-boranonacyclo[16.14.2.02,14.04,12.06,11.015,33.020,25.026,34.027,32]tetratriaconta-2(14),3,6,8,10,12,15(33),16,18(34),20,22,24,27(32),28,30-pentadecaene
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "29-tert-butyl-5-phenyl-19-oxa-1,5-diaza-26-boranonacyclo[16.14.2.02,14.04,12.06,11.015,33.020,25.026,34.027,32]tetratriaconta-2(14),3,6,8,10,12,15(33),16,18(34),20,22,24,27(32),28,30-pentadecaene", "role": "assistant" } ]
298,509
{ "selfies": "[O][=C][Branch2][Ring2][Ring2][N][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][C][N][Ring1][=Branch1][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=C][C][=C][Branch1][#C][C][#C][C][=C][C][=C][Branch1][Ring1][C][O][C][=C][Ring1][Branch2][C][=C][Ring1][S][Cl]", "smiles": "O=C(NCC1CC(NC(=O)C2CC(F)CN2)CN1C(=O)C1CC1)c1ccc(C#Cc2ccc(CO)cc2)cc1Cl" }
(2S,4S)-N-[(3R,5R)-5-[[[2-chloro-4-[2-[4-(hydroxymethyl)phenyl]ethynyl]benzoyl]amino]methyl]-1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-4-fluoropyrrolidine-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2S,4S)-N-[(3R,5R)-5-[[[2-chloro-4-[2-[4-(hydroxymethyl)phenyl]ethynyl]benzoyl]amino]methyl]-1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-4-fluoropyrrolidine-2-carboxamide", "role": "assistant" } ]
298,510
{ "selfies": "[C][C][=C][C][Branch2][Ring1][#C][C][=C][N][=C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][=N][O][Ring2][Ring1][C][=C][C][=C][Ring2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][C][N][Ring1][=Branch1][C][N][Ring1][=C][C][=Branch1][C][=O][C][Branch1][C][C][C]", "smiles": "Cc1cc(-c2cnc(-c3ccc(CN4CCOCC4)cc3)o2)ccc1C(=O)NCC1CC(NC(=O)C2CC(F)CN2)CN1C(=O)C(C)C" }
(2S,4S)-4-fluoro-N-[(3R,5R)-5-[[[2-methyl-4-[2-[4-(morpholin-4-ylmethyl)phenyl]-1,3-oxazol-5-yl]benzoyl]amino]methyl]-1-(2-methylpropanoyl)pyrrolidin-3-yl]pyrrolidine-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "(2S,4S)-4-fluoro-N-[(3R,5R)-5-[[[2-methyl-4-[2-[4-(morpholin-4-ylmethyl)phenyl]-1,3-oxazol-5-yl]benzoyl]amino]methyl]-1-(2-methylpropanoyl)pyrrolidin-3-yl]pyrrolidine-2-carboxamide", "role": "assistant" } ]
298,511
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch2][Branch1][Ring2][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][C][Ring1][#C][C][Ring1][#Branch1][C][=C][C][=C][Ring2][Ring2][Ring1][Ring2][Ring2][O]", "smiles": "CC1(C)c2ccccc2-c2c(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cccc21" }
N-(9,9-dimethylfluoren-4-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "N-(9,9-dimethylfluoren-4-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)spiro[adamantane-2,9'-fluorene]-2'-amine", "role": "assistant" } ]
298,512
{ "selfies": "[C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][Branch1][C][O][C][Branch1][C][C][C][C][Ring1][Branch2][O][Ring1][O]", "smiles": "COC(C)(C)C1CC2CC(O)C(C)CC2O1" }
2-(2-methoxypropan-2-yl)-6-methyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran-5-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "2-(2-methoxypropan-2-yl)-6-methyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran-5-ol", "role": "assistant" } ]
298,513
{ "selfies": "[C][C][C][C][C][C][=C][C][C][C][C][O][Si][Branch1][C][C][Branch2][Ring2][S][C][C][C][C][C][N][Branch1][C][C][C][C][N][Branch1][C][C][C][C][C][C][Si][Branch1][C][C][Branch1][N][O][C][C][C][C][=C][C][C][C][C][C][O][C][C][C][C][C][C][C][C][C][C][O][C][C][C][C][=C][C][C][C][C][C]", "smiles": "CCCCCC=CCCCCO[Si](C)(CCCCCN(C)CCN(C)CCCC[Si](C)(OCCCC=CCCCCC)OCCCCCCCCCC)OCCCC=CCCCCC" }
N'-[4-[[(Z)-dec-4-enoxy]-decoxy-methylsilyl]butyl]-N-[5-[[(Z)-dec-4-enoxy]-methyl-[(Z)-undec-5-enoxy]silyl]pentyl]-N,N'-dimethylethane-1,2-diamine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "N'-[4-[[(Z)-dec-4-enoxy]-decoxy-methylsilyl]butyl]-N-[5-[[(Z)-dec-4-enoxy]-methyl-[(Z)-undec-5-enoxy]silyl]pentyl]-N,N'-dimethylethane-1,2-diamine", "role": "assistant" } ]
298,514
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][C][C][N][C][C][Branch1][=Branch2][C][C][Branch1][C][O][C][Ring1][Branch1][C][Ring1][Branch2][C][=C][Ring1][#C][C][=C][Ring2][Ring1][#Branch2]", "smiles": "COc1ccc(CNC(=O)Nc2ccc(CN3CC4(CC(O)C4)C3)cc2)cc1" }
1-[4-[(6-hydroxy-2-azaspiro[3.3]heptan-2-yl)methyl]phenyl]-3-[(4-methoxyphenyl)methyl]urea
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "1-[4-[(6-hydroxy-2-azaspiro[3.3]heptan-2-yl)methyl]phenyl]-3-[(4-methoxyphenyl)methyl]urea", "role": "assistant" } ]
298,515
{ "selfies": "[O][=C][C][C][N][=C][S][C][=Ring1][Branch1][C][O][Ring1][=Branch2]", "smiles": "O=C1Cc2ncsc2CO1" }
4,7-dihydropyrano[4,3-d][1,3]thiazol-6-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "4,7-dihydropyrano[4,3-d][1,3]thiazol-6-one", "role": "assistant" } ]
298,516
{ "selfies": "[C][=C][C][=C][Branch2][Ring2][N][C][=C][C][Branch2][Ring1][Branch1][N][C][=C][C][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N][=Ring1][=Branch2][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][O][=Ring1][=Branch2][C][=C][Ring2][Ring1][P]", "smiles": "c1ccc(-c2cc(Nc3cccc4oc5ccccc5c34)cc3oc4ccccc4c23)cc1" }
N-dibenzofuran-1-yl-1-phenyldibenzofuran-3-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "N-dibenzofuran-1-yl-1-phenyldibenzofuran-3-amine", "role": "assistant" } ]
298,517
{ "selfies": "[O][=C][C][C][=C][C][=C][Branch2][Branch1][=Branch1][C][=C][C][=C][Branch2][Ring2][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=N][Ring1][#Branch2][C][Branch1][C][O][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring1][P][C][N][Ring2][Ring2][Branch1]", "smiles": "O=C1Cc2ccc(-c3ccc(S(=O)(=O)N4CCC(Nc5ccc(C(F)(F)F)cn5)C(O)C4)cc3)cc2CN1" }
7-[4-[(3S,4R)-3-hydroxy-4-[[5-(trifluoromethyl)pyridin-2-yl]amino]piperidin-1-yl]sulfonylphenyl]-2,4-dihydro-1H-isoquinolin-3-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "7-[4-[(3S,4R)-3-hydroxy-4-[[5-(trifluoromethyl)pyridin-2-yl]amino]piperidin-1-yl]sulfonylphenyl]-2,4-dihydro-1H-isoquinolin-3-one", "role": "assistant" } ]
298,518
{ "selfies": "[N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][=Branch1][C][=C][C][=C][Branch2][Ring2][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=N][Ring1][#Branch2][C][Branch1][C][O][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O][C][=N][Ring2][Ring1][P]", "smiles": "NC(=O)c1ccc(-c2ccc(S(=O)(=O)N3CCC(Nc4ccc(C(F)(F)F)cn4)C(O)C3)cc2)cn1" }
5-[4-[(3S,4R)-3-hydroxy-4-[[5-(trifluoromethyl)pyridin-2-yl]amino]piperidin-1-yl]sulfonylphenyl]pyridine-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "5-[4-[(3S,4R)-3-hydroxy-4-[[5-(trifluoromethyl)pyridin-2-yl]amino]piperidin-1-yl]sulfonylphenyl]pyridine-2-carboxamide", "role": "assistant" } ]
298,519
{ "selfies": "[C][C][=C][C][=C][Branch2][=Branch1][=Branch1][N][Branch2][Ring1][Ring2][C][=C][C][=C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=C][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring1]", "smiles": "Cc1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccccc2-c2ccccc2-n2c3ccccc3c3ccc(-c4ccccc4)cc32)cc1" }
N-(4-methylphenyl)-N-[2-[2-(2-phenylcarbazol-9-yl)phenyl]phenyl]dibenzofuran-2-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "N-(4-methylphenyl)-N-[2-[2-(2-phenylcarbazol-9-yl)phenyl]phenyl]dibenzofuran-2-amine", "role": "assistant" } ]
298,520
{ "selfies": "[C][=C][C][=C][Branch2][=Branch1][P][C][=C][C][=C][Branch2][=Branch1][Branch1][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Ring1][N][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][C][C][=C][Ring2][Branch1][Branch2]", "smiles": "c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccccc3-c3ccccc3-n3c4ccccc4c4c(-c5ccccc5)cccc43)cc2)cc1" }
2-[2-(4-phenylcarbazol-9-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2-[2-(4-phenylcarbazol-9-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline", "role": "assistant" } ]
298,521
{ "selfies": "[C][O][C][=C][C][=C][Branch2][=Branch1][Branch2][C][N][C][=Branch1][C][=O][C][C][C][Branch2][Branch1][#Branch1][N][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Branch1][C][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][Ring1][P][=C][C][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][N][C][Ring2][Ring2][Ring1][=O][C][=C][Ring2][Ring2][O]", "smiles": "COc1ccc(CN2C(=O)CCC(n3c(=O)n(C)c4cc(N5CCC(COS(=O)(=O)c6ccc(C)cc6)C5)ccc43)C2=O)cc1" }
[(3R)-1-[1-[1-[(4-methoxyphenyl)methyl]-2,6-dioxopiperidin-3-yl]-3-methyl-2-oxobenzimidazol-5-yl]pyrrolidin-3-yl]methyl 4-methylbenzenesulfonate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "[(3R)-1-[1-[1-[(4-methoxyphenyl)methyl]-2,6-dioxopiperidin-3-yl]-3-methyl-2-oxobenzimidazol-5-yl]pyrrolidin-3-yl]methyl 4-methylbenzenesulfonate", "role": "assistant" } ]
298,522
{ "selfies": "[C][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][=N][N][Ring1][=C][C][C][O][Si][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "Cc1c(B2OC(C)(C)C(C)(C)O2)cnn1CCO[Si](C)(C)C(C)(C)C" }
tert-butyl-dimethyl-[2-[5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethoxy]silane
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "tert-butyl-dimethyl-[2-[5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethoxy]silane", "role": "assistant" } ]
298,523
{ "selfies": "[C][=C][Branch1][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][=Branch1][C][N+1][Branch1][Ring1][C][C][=C][C][=C][C][=Branch2][Ring2][P][=C][C][=Branch1][C][=O][C][Branch2][Ring2][Ring1][C][=C][C][=C][Branch2][Ring1][#Branch1][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch1][Branch2][O][C][C][C][O][Ring1][Ring1][C][=C][Ring1][O][C][=C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][=Branch2][O-1][C][=C][Ring2][Ring1][S][C][=C][Ring2][Ring2][=Branch2]", "smiles": "C=C(C)C(=O)Oc1ccc([N+](CC)=C2C=CC(=C3C(=O)C(c4ccc(N(CC)c5ccc(OCC6CO6)cc5)cc4)=C3[O-])C=C2)cc1" }
4-[4-[ethyl-[4-(2-methylprop-2-enoyloxy)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-ethyl-4-(oxiran-2-ylmethoxy)anilino]phenyl]-3-oxocyclobuten-1-olate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "4-[4-[ethyl-[4-(2-methylprop-2-enoyloxy)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-ethyl-4-(oxiran-2-ylmethoxy)anilino]phenyl]-3-oxocyclobuten-1-olate", "role": "assistant" } ]
298,524
{ "selfies": "[C][=C][Branch1][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][=Branch1][Ring1][N][Branch1][C][C][C][=C][C][=C][Branch2][Branch1][Ring1][C][=C][Branch1][C][O-1][C][Branch2][Ring2][Branch1][C][C][=C][C][=Branch2][Ring1][=Branch2][=N+1][Branch1][C][C][C][=C][C][=C][Branch1][O][O][C][=Branch1][C][=O][C][=Branch1][C][=C][C][C][=C][Ring1][N][C][=C][Ring2][Ring1][Ring2][C][Ring2][Ring1][=Branch2][=O][C][=C][Ring2][Ring1][S][C][=C][Ring2][Ring2][Branch2]", "smiles": "C=C(C)C(=O)Oc1ccc(N(C)c2ccc(C3=C([O-])C(C4C=CC(=[N+](C)c5ccc(OC(=O)C(=C)C)cc5)C=C4)C3=O)cc2)cc1" }
2-[4-[N-methyl-4-(2-methylprop-2-enoyloxy)anilino]phenyl]-4-[4-[methyl-[4-(2-methylprop-2-enoyloxy)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-yl]-3-oxocyclobuten-1-olate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "2-[4-[N-methyl-4-(2-methylprop-2-enoyloxy)anilino]phenyl]-4-[4-[methyl-[4-(2-methylprop-2-enoyloxy)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-yl]-3-oxocyclobuten-1-olate", "role": "assistant" } ]
298,525
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][Ring1][C][=C][C][=C][C][Branch2][=Branch1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][C][=C][C][=C][C][=C][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][O][=C][Ring1][#C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1][=C][Ring2][Ring2][P][C][=C][Ring2][Branch1][#Branch1]", "smiles": "c1ccc(-c2cccc(-c3ccccc3N(c3ccc4c(c3)sc3ccccc34)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)c2)cc1" }
N-dibenzothiophen-3-yl-2-phenyl-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazol-10-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "N-dibenzothiophen-3-yl-2-phenyl-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazol-10-amine", "role": "assistant" } ]
298,526
{ "selfies": "[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][=C][Ring2][Ring1][#C]", "smiles": "COC(=O)c1cc(NC(=O)c2cccnc2)cc(NC(=O)n2c3ccccc3c3ccccc32)c1" }
methyl 3-(carbazole-9-carbonylamino)-5-(pyridine-3-carbonylamino)benzoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "methyl 3-(carbazole-9-carbonylamino)-5-(pyridine-3-carbonylamino)benzoate", "role": "assistant" } ]
298,527
{ "selfies": "[C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][N][=C][Branch1][C][C][N][Branch1][Branch2][C][C][=Branch1][C][=O][O][C][C][Ring1][O][=O][N][=C][Ring2][Ring1][Ring1]", "smiles": "CCN(CC)c1ccc(C=C2N=C(C)N(CC(=O)OC)C2=O)nc1" }
methyl 2-[(4Z)-4-[[5-(diethylamino)pyridin-2-yl]methylidene]-2-methyl-5-oxoimidazol-1-yl]acetate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "methyl 2-[(4Z)-4-[[5-(diethylamino)pyridin-2-yl]methylidene]-2-methyl-5-oxoimidazol-1-yl]acetate", "role": "assistant" } ]
298,528
{ "selfies": "[O][C][=C][Branch2][Ring1][C][C][=C][C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][O][C][=C][C][Branch1][C][F][=C][Ring2][Ring1][C][F]", "smiles": "Oc1c(C2=CCC(N3CCOCC3)=C2)ccc(F)c1F" }
2,3-difluoro-6-(4-morpholin-4-ylcyclopenta-1,4-dien-1-yl)phenol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "2,3-difluoro-6-(4-morpholin-4-ylcyclopenta-1,4-dien-1-yl)phenol", "role": "assistant" } ]
298,529
{ "selfies": "[C][N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][C][Ring1][Branch2][C][=Branch1][C][=O][N][C][Branch1][#Branch2][C][C][C][C][N][C][Ring1][Branch1][=O][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1]", "smiles": "Cn1nc2ccccc2c1C(=O)N1CCC2(CC2)CC1C(=O)NC(CC1CCNC1=O)C(=O)C(=O)NC1CC1" }
(7S)-N-[(2S)-4-(cyclopropylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-6-(2-methylindazole-3-carbonyl)-6-azaspiro[2.5]octane-7-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "(7S)-N-[(2S)-4-(cyclopropylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-6-(2-methylindazole-3-carbonyl)-6-azaspiro[2.5]octane-7-carboxamide", "role": "assistant" } ]
298,530
{ "selfies": "[C][C][N][=C][Branch1][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Branch1][O][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][N][N][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=Branch2][N][=C][Ring1][S][Ring2][Ring2][Ring1]", "smiles": "CC1N=C(c2c(F)cccc2F)c2c(ccc(Cl)c2Cl)-n2nc(C(=O)N3CC4(CCOCC4)C3)nc21" }
[(4S)-7,8-dichloro-6-(2,6-difluorophenyl)-4-methyl-4H-[1,2,4]triazolo[1,5-a][1,4]benzodiazepin-2-yl]-(7-oxa-2-azaspiro[3.5]nonan-2-yl)methanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "[(4S)-7,8-dichloro-6-(2,6-difluorophenyl)-4-methyl-4H-[1,2,4]triazolo[1,5-a][1,4]benzodiazepin-2-yl]-(7-oxa-2-azaspiro[3.5]nonan-2-yl)methanone", "role": "assistant" } ]
298,531
{ "selfies": "[C][C][N][=C][Branch1][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Branch1][O][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][N][N][=C][Branch1][=Branch2][N][C][C][C][C][Ring1][Branch1][=O][N][=C][Ring1][O][Ring2][Ring1][=C]", "smiles": "CC1N=C(c2c(F)cccc2F)c2c(ccc(Cl)c2Cl)-n2nc(N3CCCC3=O)nc21" }
1-[(4S)-7,8-dichloro-6-(2,6-difluorophenyl)-4-methyl-4H-[1,2,4]triazolo[1,5-a][1,4]benzodiazepin-2-yl]pyrrolidin-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "1-[(4S)-7,8-dichloro-6-(2,6-difluorophenyl)-4-methyl-4H-[1,2,4]triazolo[1,5-a][1,4]benzodiazepin-2-yl]pyrrolidin-2-one", "role": "assistant" } ]
298,532
{ "selfies": "[N][C][N][=C][Branch2][Ring1][Branch2][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring1][N][S][C][=Ring2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1]", "smiles": "Nc1nc(Nc2ccc(OC(F)(F)F)c(Cl)c2)sc1C(=O)c1ccncc1" }
[4-amino-2-[3-chloro-4-(trifluoromethoxy)anilino]-1,3-thiazol-5-yl]-pyridin-4-ylmethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "[4-amino-2-[3-chloro-4-(trifluoromethoxy)anilino]-1,3-thiazol-5-yl]-pyridin-4-ylmethanone", "role": "assistant" } ]
298,533
{ "selfies": "[O][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][O][C][C][C][C][C][Ring1][Branch1][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][=Branch2][C][=Branch1][C][=O][O][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][C][C][C][C][Ring1][N]", "smiles": "O=C(CN1CCOCC1)OC1C2CC3C1OC(=O)C3C2C(=O)OC1(C2CCCCC2)CCCCC1" }
(1-cyclohexylcyclohexyl) 2-(2-morpholin-4-ylacetyl)oxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "(1-cyclohexylcyclohexyl) 2-(2-morpholin-4-ylacetyl)oxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylate", "role": "assistant" } ]
298,534
{ "selfies": "[C][C][Branch1][C][C][Branch2][Ring2][Branch2][O][C][=Branch1][C][=O][C][C][C][C][C][Branch1][O][O][C][=Branch1][C][=O][C][Ring1][=Branch1][Ring1][=Branch2][C][Ring1][=Branch2][O][C][=Branch1][C][=O][C][N][C][C][O][C][C][Ring1][=Branch1][O][C][C][C][C][C][Ring1][Branch1]", "smiles": "CC(C)(OC(=O)C1C2CC3C(OC(=O)C31)C2OC(=O)CN1CCOCC1)OC1CCCC1" }
2-cyclopentyloxypropan-2-yl 2-(2-morpholin-4-ylacetyl)oxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "2-cyclopentyloxypropan-2-yl 2-(2-morpholin-4-ylacetyl)oxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylate", "role": "assistant" } ]
298,535
{ "selfies": "[C][=C][C][=C][C][=C][Branch1][O][C][C][S+1][C][C][O][C][C][Ring1][=Branch1][C][=C][C][Ring1][=C][=C][Ring2][Ring1][C]", "smiles": "c1ccc2cc(CC[S+]3CCOCC3)ccc2c1" }
4-(2-naphthalen-2-ylethyl)-1,4-oxathian-4-ium
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "4-(2-naphthalen-2-ylethyl)-1,4-oxathian-4-ium", "role": "assistant" } ]
298,536
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][S][C][=C][C][=C][Branch2][#Branch1][Ring2][C][=N][C][Branch2][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][C][Ring2][Ring1][=Branch2][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][=N][Ring2][Branch1][C][C][=C][Ring2][Branch1][Branch2][C][=C][Ring2][Branch1][=C]", "smiles": "c1ccc(-c2ccc(-c3nc(-c4ccccc4-n4c5ccccc5c5cc(-c6ccccc6)cc(-c6ccccc6)c54)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1" }
9-[2-[4-carbazol-9-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-diphenylcarbazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "9-[2-[4-carbazol-9-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-diphenylcarbazole", "role": "assistant" } ]
298,537
{ "selfies": "[C][=C][C][=C][Branch2][=Branch1][Ring1][C][=N][C][Branch2][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][C][Branch2][Ring1][#C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][Ring1][=C][=C][Ring2][Ring1][C][O][Ring1][=Branch1][=N][Ring2][Ring2][=Branch1][C][=C][Ring2][Ring2][N]", "smiles": "c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(-c3ccc4ccc5ccc6cccc7c6c5c4c3O7)n2)cc1" }
2-dibenzothiophen-3-yl-4-(19-oxapentacyclo[13.3.1.05,18.08,17.011,16]nonadeca-1,3,5(18),6,8(17),9,11(16),12,14-nonaen-2-yl)-6-phenyl-1,3,5-triazine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "2-dibenzothiophen-3-yl-4-(19-oxapentacyclo[13.3.1.05,18.08,17.011,16]nonadeca-1,3,5(18),6,8(17),9,11(16),12,14-nonaen-2-yl)-6-phenyl-1,3,5-triazine", "role": "assistant" } ]
298,538
{ "selfies": "[C][=C][C][=C][Branch2][=Branch1][=Branch2][C][=N][C][Branch2][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][=N][C][Branch2][Ring1][#C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][Ring1][=C][=C][Ring2][Ring1][C][O][Ring1][=Branch1][=N][Ring2][Ring2][N][C][=C][Ring2][Branch1][C]", "smiles": "c1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4ccccc43)nc(-c3ccc4ccc5ccc6cccc7c6c5c4c3O7)n2)cc1" }
9-[2-[4-(19-oxapentacyclo[13.3.1.05,18.08,17.011,16]nonadeca-1,3,5(18),6,8(17),9,11(16),12,14-nonaen-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "9-[2-[4-(19-oxapentacyclo[13.3.1.05,18.08,17.011,16]nonadeca-1,3,5(18),6,8(17),9,11(16),12,14-nonaen-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole", "role": "assistant" } ]
298,540
{ "selfies": "[C][C][=C][Branch1][Ring1][C][=O][C][=C][C][=C][Ring1][Branch2][O][C][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "Cc1c(C=O)cccc1OCC(F)(F)F" }
2-methyl-3-(2,2,2-trifluoroethoxy)benzaldehyde
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "2-methyl-3-(2,2,2-trifluoroethoxy)benzaldehyde", "role": "assistant" } ]
298,541
{ "selfies": "[C-1][#N+1][C][Branch1][Ring1][C][#N][=C][S][C][=C][Branch2][Branch1][P][O][C][=Branch1][C][=O][C][C][C][C][Branch2][Ring2][S][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][Ring1][#C][C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][C][Branch1][C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Ring2][Ring1][#Branch2][C][C][Ring2][Ring2][Ring1][C][=C][Branch1][C][C][C][Branch1][C][O][=C][Ring2][Ring2][=C][S][Ring2][Ring2][P]", "smiles": "[C-]#[N+]C(C#N)=C1Sc2c(OC(=O)C3CCC(C(=O)Oc4ccc(CCOC(=O)CCC(=O)OCC(C)(C)COC(=O)C=C)cc4)CC3)cc(C)c(O)c2S1" }
4-O-[(2Z)-2-[cyano(isocyano)methylidene]-4-hydroxy-5-methyl-1,3-benzodithiol-7-yl] 1-O-[4-[2-[4-(2,2-dimethyl-3-prop-2-enoyloxypropoxy)-4-oxobutanoyl]oxyethyl]phenyl] cyclohexane-1,4-dicarboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "4-O-[(2Z)-2-[cyano(isocyano)methylidene]-4-hydroxy-5-methyl-1,3-benzodithiol-7-yl] 1-O-[4-[2-[4-(2,2-dimethyl-3-prop-2-enoyloxypropoxy)-4-oxobutanoyl]oxyethyl]phenyl] cyclohexane-1,4-dicarboxylate", "role": "assistant" } ]
298,542
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][=N][C][=N][C][Branch2][Branch1][#Branch2][C][=C][C][=C][Branch2][Ring2][=C][C][=C][C][=C][Branch2][Ring1][N][C][=N][C][=C][Branch2][Ring1][C][C][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][Ring1][=N][O][Ring1][S][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch2][Ring1][=Branch1][C][=C][Ring2][Ring1][S][=C][C][Branch2][Ring1][Branch1][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][#Branch2][=N][Ring2][Branch1][Ring2][C][=C][Ring2][Branch1][#Branch2]", "smiles": "c1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc6c(ccc7oc8ccccc8c76)o5)c5ccccc45)cc3)cc(-c3ccnc4c3ccc3cccnc34)n2)cc1" }
2-[4-[4-[6-(1,10-phenanthrolin-4-yl)-2-phenylpyrimidin-4-yl]phenyl]naphthalen-1-yl]-[1]benzofuro[3,2-e][1,3]benzoxazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "2-[4-[4-[6-(1,10-phenanthrolin-4-yl)-2-phenylpyrimidin-4-yl]phenyl]naphthalen-1-yl]-[1]benzofuro[3,2-e][1,3]benzoxazole", "role": "assistant" } ]
298,543
{ "selfies": "[C][=C][C][=C][Branch2][=Branch1][S][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Branch2][Branch1][#Branch2][C][=C][C][=C][Branch2][Ring2][Branch2][C][=C][C][=C][C][Branch2][Ring1][N][C][=N][C][=C][Branch2][Ring1][C][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Ring1][=Branch2][Ring1][=N][O][Ring1][S][=C][Ring2][Ring1][=Branch1][C][=N][C][=C][N][=C][Ring2][Ring1][S][Ring1][=Branch1][=N][Ring2][Ring2][N][C][=C][Ring2][Branch1][C]", "smiles": "c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc(-c5nc6c(ccc7c8ccccc8oc76)o5)c4)c4nccnc34)n2)cc1" }
2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)quinoxalin-5-yl]phenyl]-[1]benzofuro[2,3-e][1,3]benzoxazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)quinoxalin-5-yl]phenyl]-[1]benzofuro[2,3-e][1,3]benzoxazole", "role": "assistant" } ]
298,544
{ "selfies": "[Br][C][=C][C][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Ring1][O][C][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2]", "smiles": "Brc1cc2nc(-c3ccccc3)oc2c2c1oc1ccccc12" }
5-bromo-2-phenyl-[1]benzofuro[2,3-g][1,3]benzoxazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "5-bromo-2-phenyl-[1]benzofuro[2,3-g][1,3]benzoxazole", "role": "assistant" } ]
298,545
{ "selfies": "[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][C][=C][Branch1][C][C][C][=C][C][C][O][C][C][O][Ring1][=Branch1]", "smiles": "CCOC(=O)C=C(C)C=CC=C(C)C=CC1COCCO1" }
ethyl (2E,4E,6E,8E)-9-(1,4-dioxan-2-yl)-3,7-dimethylnona-2,4,6,8-tetraenoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "ethyl (2E,4E,6E,8E)-9-(1,4-dioxan-2-yl)-3,7-dimethylnona-2,4,6,8-tetraenoate", "role": "assistant" } ]
298,546
{ "selfies": "[C][O][C][C][O][C][C][Branch2][Ring2][=Branch2][O][P][O][C][Branch2][Ring1][Branch2][C][Si][Branch1][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][N][Ring1][Branch1][Ring2][Ring1][#Branch1][C][Branch2][Ring2][Branch2][C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][O][C][Ring2][Branch1][=Branch1][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O]", "smiles": "COCCOC1C(OP2OC(C[Si](C)(c3ccccc3)c3ccccc3)C3CCCN32)C(COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)OC1n1cc(C)c(=O)[nH]c1=O" }
1-[(2R,4S,5R)-4-[[(1R,3S,3aS)-3-[[methyl(diphenyl)silyl]methyl]-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaphosphol-1-yl]oxy]-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-(2-methoxyethoxy)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "1-[(2R,4S,5R)-4-[[(1R,3S,3aS)-3-[[methyl(diphenyl)silyl]methyl]-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaphosphol-1-yl]oxy]-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-(2-methoxyethoxy)oxolan-2-yl]-5-methylpyrimidine-2,4-dione", "role": "assistant" } ]
298,547
{ "selfies": "[C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch2][#C][=N][O][C][O][C][Branch2][O][O][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][C][C][O][C][Branch2][=Branch2][=N][O][C][O][C][Branch2][Branch2][=Branch2][C][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][C][O][C][Branch2][Ring1][O][O][C][C][Branch1][C][O][C][Branch1][Ring1][C][O][O][C][Branch1][Ring1][O][C][C][Ring1][O][N][C][Branch1][C][C][=O][C][Branch1][C][O][C][Branch1][C][O][C][Ring2][Ring1][Branch2][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch2][Ring1][Branch2][O][C][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][C][Branch1][C][O][C][Ring1][O][O][C][Ring2][Ring1][=Branch1][N][C][Branch1][C][C][=O][C][Branch1][C][O][C][Branch1][C][O][C][Ring2][=Branch1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring2][=Branch1][N][O][C][Branch2][Ring2][#C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch2][Ring1][Branch1][O][C][O][C][Branch1][Ring1][C][=O][C][Branch1][C][C][C][Branch1][C][O][C][Ring1][#Branch2][O][C][Ring2][Ring1][Branch1][N][C][Branch1][C][C][=O][C][Branch1][C][O][C][Ring2][=Branch2][Branch1][O][C][Ring2][=Branch2][S][N][C][Branch1][C][C][=O]", "smiles": "COC1OC(CO)C(O)C(OC2OC(C(=O)NNC(=O)CC3OC(OC4OC(CC(=O)NNC(=O)C5OC(OC6C(O)C(CO)OC(OC)C6NC(C)=O)C(O)C(O)C5OC5OC(CO)C(O)C(OC6OC(C(=O)O)C(C)C(O)C6O)C5NC(C)=O)C(O)C(O)C4O)C(O)C(O)C3O)C(OC3OC(CO)C(O)C(OC4OC(C=O)C(C)C(O)C4O)C3NC(C)=O)C(O)C2O)C1NC(C)=O" }
(3S,4S,6R)-6-[(2S,4R,5S)-3-acetamido-2-[(3S,4R,6R)-2-[[[2-[(3S,4S,6R)-6-[(2R,4S,5S)-6-[2-[2-[(3S,4R,5S)-3-[(2S,4R,5S)-3-acetamido-4-[(2R,4S,5S)-6-formyl-3,4-dihydroxy-5-methyloxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(3S,4R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy-4,5-dihydroxyoxane-2-carbonyl]hydrazinyl]-2-oxoethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]acetyl]amino]carbamoyl]-6-[(3S,4R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-3-methyloxane-2-carboxylic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "(3S,4S,6R)-6-[(2S,4R,5S)-3-acetamido-2-[(3S,4R,6R)-2-[[[2-[(3S,4S,6R)-6-[(2R,4S,5S)-6-[2-[2-[(3S,4R,5S)-3-[(2S,4R,5S)-3-acetamido-4-[(2R,4S,5S)-6-formyl-3,4-dihydroxy-5-methyloxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(3S,4R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy-4,5-dihydroxyoxane-2-carbonyl]hydrazinyl]-2-oxoethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]acetyl]amino]carbamoyl]-6-[(3S,4R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-3-methyloxane-2-carboxylic acid", "role": "assistant" } ]
298,548
{ "selfies": "[C][=C][C][=C][N][=C][Branch2][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Branch1][#Branch2][C][=C][C][=C][C][Branch2][Ring2][=N][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring1][Branch2][C][N][C][Branch1][C][C][C][O][Si][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=N][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=C][C][=C][Ring2][Ring2][Branch1][C][C][=C][Ring2][Ring2][#C][O][C]", "smiles": "C=Cc1cnc(C(=O)Nc2cccc(-c3cccc(NC(=O)c4cc(OC)c(CNC(C)CO[Si](C)(C)C(C)(C)C)cn4)c3C)c2C)cc1OC" }
5-[[[(2S)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]amino]methyl]-N-[3-[3-[(5-ethenyl-4-methoxypyridine-2-carbonyl)amino]-2-methylphenyl]-2-methylphenyl]-4-methoxypyridine-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "5-[[[(2S)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]amino]methyl]-N-[3-[3-[(5-ethenyl-4-methoxypyridine-2-carbonyl)amino]-2-methylphenyl]-2-methylphenyl]-4-methoxypyridine-2-carboxamide", "role": "assistant" } ]
298,549
{ "selfies": "[C][P][Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][N][C][=N][C][Branch2][Ring1][N][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][=N][=N][C][=C][Ring2][Ring1][#Branch1][Cl]", "smiles": "CP(C)(=O)c1cc(OC(F)F)ccc1Nc1nc(Nc2ccc3c(c2)CCC(N2CCCC2)CC3)ncc1Cl" }
5-chloro-4-N-[4-(difluoromethoxy)-2-dimethylphosphorylphenyl]-2-N-[(7S)-7-pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl]pyrimidine-2,4-diamine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "5-chloro-4-N-[4-(difluoromethoxy)-2-dimethylphosphorylphenyl]-2-N-[(7S)-7-pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl]pyrimidine-2,4-diamine", "role": "assistant" } ]
298,550
{ "selfies": "[C][N][C][Branch1][O][N][C][C][O][C][C][C][Ring1][=Branch1][O][=N][C][Branch1][P][C][=C][C][=C][C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][=C][N][=Ring1][=Branch1][=C][Ring2][Ring1][#Branch1][O]", "smiles": "Cn1c(NC2COCCC2O)nc(C=c2ccc3c(c2)N=CN=3)c1O" }
5-[(E)-benzimidazol-5-ylidenemethyl]-2-[[(3R,4R)-4-hydroxyoxan-3-yl]amino]-3-methylimidazol-4-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "5-[(E)-benzimidazol-5-ylidenemethyl]-2-[[(3R,4R)-4-hydroxyoxan-3-yl]amino]-3-methylimidazol-4-ol", "role": "assistant" } ]
298,551
{ "selfies": "[C][N][C][=Branch1][C][=O][C][=Branch1][#C][=C][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][Ring1][S][=N][C][C][C][C][C][C][Ring1][=Branch1]", "smiles": "CN1C(=O)C(=Cc2ccc3ncsc3c2)NC1=NC1CCCCC1" }
(5Z)-5-(1,3-benzothiazol-6-ylmethylidene)-2-cyclohexylimino-3-methylimidazolidin-4-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "(5Z)-5-(1,3-benzothiazol-6-ylmethylidene)-2-cyclohexylimino-3-methylimidazolidin-4-one", "role": "assistant" } ]
298,552
{ "selfies": "[C][N][C][=Branch1][C][=O][C][=Branch1][#C][=C][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][Ring1][S][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=Branch2][O]", "smiles": "CN1C(=O)C(=Cc2ccc3ncsc3c2)NC1=NC1c2ccccc2CC1O" }
(5Z)-5-(1,3-benzothiazol-6-ylmethylidene)-2-[[(1S,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]imino]-3-methylimidazolidin-4-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "(5Z)-5-(1,3-benzothiazol-6-ylmethylidene)-2-[[(1S,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]imino]-3-methylimidazolidin-4-one", "role": "assistant" } ]
298,554
{ "selfies": "[C][C][N][C][Branch1][N][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Branch2][Ring2][N][C][=C][C][Branch1][=C][O][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][N][O][C][C][C][O][C][C][Ring1][=Branch1][O][C][=N][C][=C][C][Ring1][#C][=C][Ring2][Ring1][#Branch2][C][Ring2][Ring2][Branch2][=O]", "smiles": "CCn1c(COCc2ccccc2)nn(-c2cc(OC(C)C(F)(F)F)c3c(OC4CCOCC4OC)nccc3c2)c1=O" }
4-ethyl-2-[1-(3-methoxyoxan-4-yl)oxy-8-[(2S)-1,1,1-trifluoropropan-2-yl]oxyisoquinolin-6-yl]-5-(phenylmethoxymethyl)-1,2,4-triazol-3-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "4-ethyl-2-[1-(3-methoxyoxan-4-yl)oxy-8-[(2S)-1,1,1-trifluoropropan-2-yl]oxyisoquinolin-6-yl]-5-(phenylmethoxymethyl)-1,2,4-triazol-3-one", "role": "assistant" } ]
298,555
{ "selfies": "[C][C][=Branch1][C][=O][C][=N][N][Branch1][#C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][P][Ring1][=Branch1][C][=C][N][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][C][=C][Ring1][=C]", "smiles": "CC(=O)c1nn(CC(=O)OC(C)(C)C)c2cc3c(cc12)-c1cnc(C)nc1CC=C3" }
tert-butyl 2-(16-acetyl-5-methyl-4,6,14,15-tetrazatetracyclo[9.7.0.02,7.013,17]octadeca-1(18),2,4,6,9,11,13(17),15-octaen-14-yl)acetate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "tert-butyl 2-(16-acetyl-5-methyl-4,6,14,15-tetrazatetracyclo[9.7.0.02,7.013,17]octadeca-1(18),2,4,6,9,11,13(17),15-octaen-14-yl)acetate", "role": "assistant" } ]
298,556
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Br][C][Branch1][Ring1][P][=O][=C][Ring1][=Branch2]", "smiles": "CC(C)(C)OC(=O)Nc1ccc(Br)c(P=O)c1" }
tert-butyl N-(4-bromo-3-phosphorosophenyl)carbamate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "tert-butyl N-(4-bromo-3-phosphorosophenyl)carbamate", "role": "assistant" } ]
298,557
{ "selfies": "[C][C][Branch1][C][C][N][Branch1][=Branch1][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C]", "smiles": "CC(C)N(C(C)C)S(=O)(=O)c1ccc(C(=O)C(F)(F)C(F)(F)F)cc1S(=O)(=O)N(C(C)C)C(C)C" }
4-(2,2,3,3,3-pentafluoropropanoyl)-1-N,1-N,2-N,2-N-tetra(propan-2-yl)benzene-1,2-disulfonamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "4-(2,2,3,3,3-pentafluoropropanoyl)-1-N,1-N,2-N,2-N-tetra(propan-2-yl)benzene-1,2-disulfonamide", "role": "assistant" } ]
298,558
{ "selfies": "[C][O][C][=C][C][=C][NH1][C][=C][Branch1][=C][C][C][Branch1][C][NH3+1][B-1][Branch1][C][F][Branch1][C][F][F][C][Ring1][N][=C][Ring1][S]", "smiles": "COc1ccc2[nH]cc(CC([NH3+])[B-](F)(F)F)c2c1" }
[1-azaniumyl-2-(5-methoxy-1H-indol-3-yl)ethyl]-trifluoroboranuide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "[1-azaniumyl-2-(5-methoxy-1H-indol-3-yl)ethyl]-trifluoroboranuide", "role": "assistant" } ]
298,559
{ "selfies": "[C][C][#C][C][C][=C][N][C][Branch1][=N][N][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][=C][N][=C][Ring1][=N][C][=Ring1][P]", "smiles": "CC#Cc1ccn2c(N3CCC(=O)NC3=O)cnc2c1" }
1-(7-prop-1-ynylimidazo[1,2-a]pyridin-3-yl)-1,3-diazinane-2,4-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "1-(7-prop-1-ynylimidazo[1,2-a]pyridin-3-yl)-1,3-diazinane-2,4-dione", "role": "assistant" } ]
298,560
{ "selfies": "[C][C][=C][C][Branch1][C][C][=C][Branch2][#Branch1][Ring1][N][C][Branch1][C][C][C][=C][C][=C][C][Branch2][=Branch1][C][C][Branch1][C][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][=C][Branch2][Ring1][Ring2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring2][#C][C][Branch1][C][C][=C][Ring2][Branch1][#Branch2]", "smiles": "Cc1cc(C)c(NC(C)c2cccc(C(C)Nc3c(C4CCCCC4)cc(C(c4ccccc4)c4ccccc4)cc3C(c3ccccc3)c3ccccc3)n2)c(C)c1" }
N-[1-[6-[1-(2,4-dibenzhydryl-6-cyclohexylanilino)ethyl]pyridin-2-yl]ethyl]-2,4,6-trimethylaniline
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "N-[1-[6-[1-(2,4-dibenzhydryl-6-cyclohexylanilino)ethyl]pyridin-2-yl]ethyl]-2,4,6-trimethylaniline", "role": "assistant" } ]
298,561
{ "selfies": "[C][C][#C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring2][P][C][=N][C][Branch2][Ring1][=Branch2][C][=C][C][=C][Branch1][#C][O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][F][C][=C][Ring1][S][=C][C][=N][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][N][Ring2][Ring1][N][Ring1][=Branch2][C][Ring2][Ring1][P]", "smiles": "CC#CC(=O)N1CCC(c2nc(-c3ccc(Oc4cccc(OC)c4F)cc3)c3cncc(C(C)C)n23)C1" }
1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-5-propan-2-ylimidazo[1,5-a]pyrazin-3-yl]pyrrolidin-1-yl]but-2-yn-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-5-propan-2-ylimidazo[1,5-a]pyrazin-3-yl]pyrrolidin-1-yl]but-2-yn-1-one", "role": "assistant" } ]
298,562
{ "selfies": "[C][C][C][=N][C][=C][Branch2][Ring1][Ring2][C][Branch1][=C][C][=C][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][=N][Ring1][#C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]", "smiles": "CCc1nc2c(c(-c3ccnc4[nH]ccc34)n1)CN(C(=O)OC(C)(C)C)C2" }
tert-butyl 2-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "tert-butyl 2-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate", "role": "assistant" } ]
298,563
{ "selfies": "[C][C][Branch1][C][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2]", "smiles": "CC(O)(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1" }
N-[2-(1-hydroxy-1-phenylethyl)phenyl]-4-(trifluoromethyl)benzenesulfonamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "N-[2-(1-hydroxy-1-phenylethyl)phenyl]-4-(trifluoromethyl)benzenesulfonamide", "role": "assistant" } ]
298,564
{ "selfies": "[C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][S][C][=C][N][=C][Branch1][Ring1][C][#N][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][Branch1][C][S][N][Ring1][P][C][C][C][C][Branch1][Branch1][C][C][C][Br][C][C][Ring1][#Branch2]", "smiles": "CC1(C)C(=O)N(c2cnc(C#N)c(Cl)c2)C(S)N1C1CCC(CCCBr)CC1" }
5-[3-[4-(3-bromopropyl)cyclohexyl]-4,4-dimethyl-5-oxo-2-sulfanylimidazolidin-1-yl]-3-chloropyridine-2-carbonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "5-[3-[4-(3-bromopropyl)cyclohexyl]-4,4-dimethyl-5-oxo-2-sulfanylimidazolidin-1-yl]-3-chloropyridine-2-carbonitrile", "role": "assistant" } ]
298,565
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring2][=C][C][N][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring1][P][C][=C][Ring2][Ring1][=C]", "smiles": "COc1ccc(CNC(=O)NC2CC3(C2)CN(C(=O)C(C)(C)c2cccc(C)c2)C3)cc1" }
1-[(4-methoxyphenyl)methyl]-3-[2-[2-methyl-2-(3-methylphenyl)propanoyl]-2-azaspiro[3.3]heptan-6-yl]urea
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "1-[(4-methoxyphenyl)methyl]-3-[2-[2-methyl-2-(3-methylphenyl)propanoyl]-2-azaspiro[3.3]heptan-6-yl]urea", "role": "assistant" } ]
298,566
{ "selfies": "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][O][C][Branch2][Ring1][C][C][O][Si][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][Ring1]", "smiles": "COC(=O)c1cccc(C(CO[Si](C)(C)C(C)(C)C)C2CC2)c1" }
methyl 3-[2-[tert-butyl(dimethyl)silyl]oxy-1-cyclopropylethyl]benzoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "methyl 3-[2-[tert-butyl(dimethyl)silyl]oxy-1-cyclopropylethyl]benzoate", "role": "assistant" } ]
298,567
{ "selfies": "[C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch1][=N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=C][Ring1][=C][P][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][C][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "Cc1cccc(C)c1-c1cccc(-c2c(C)cccc2C)c1P1C(c2ccccc2)CC(=O)CC1c1ccccc1" }
1-[2,6-bis(2,6-dimethylphenyl)phenyl]-2,6-diphenylphosphinan-4-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-[2,6-bis(2,6-dimethylphenyl)phenyl]-2,6-diphenylphosphinan-4-one", "role": "assistant" } ]
298,568
{ "selfies": "[C][C][=C][C][Branch1][C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][=C][Ring2][Ring1][Branch1]", "smiles": "Cc1cc(C)c(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1" }
N-(2-chloro-3,5-dimethylphenyl)-4-nitrobenzenesulfonamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "N-(2-chloro-3,5-dimethylphenyl)-4-nitrobenzenesulfonamide", "role": "assistant" } ]
298,569
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][C][C][Branch1][C][C][O][C][C][C][=C][C][=C][C][Branch1][Branch2][C][=C][N+1][=Branch1][C][=O][O-1][=N][Ring1][O]", "smiles": "CC(C)(C)[Si](C)(C)OCCc1cccc(C=C[N+](=O)[O-])n1" }
tert-butyl-dimethyl-[2-[6-[(E)-2-nitroethenyl]pyridin-2-yl]ethoxy]silane
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "tert-butyl-dimethyl-[2-[6-[(E)-2-nitroethenyl]pyridin-2-yl]ethoxy]silane", "role": "assistant" } ]
298,570
{ "selfies": "[O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "O=C(c1ccccc1)C1CC(c2ccccc2)(c2ccccn2)C1c1ccccc1" }
[(1R,2R,3R)-2,3-diphenyl-3-pyridin-2-ylcyclobutyl]-phenylmethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "[(1R,2R,3R)-2,3-diphenyl-3-pyridin-2-ylcyclobutyl]-phenylmethanone", "role": "assistant" } ]
298,571
{ "selfies": "[C][O][C][=C][C][Branch2][Ring1][Branch1][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][N][Ring1][=Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring2][C][N][C][C][N][Branch2][=Branch1][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch2][Ring2][=N][C][C][C][N][Branch2][Ring2][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][#C][=O][C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][S][C][C][Ring2][Ring2][=Branch2]", "smiles": "COc1cc(-c2cn(C)c(=O)c3cnccc23)cc(OC)c1CN1CCN(C2CCC3(CC2)CCN(CC2CN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)C2)CC3)CC1" }
5-[3-[[9-[4-[[2,6-dimethoxy-4-(2-methyl-1-oxo-2,7-naphthyridin-4-yl)phenyl]methyl]piperazin-1-yl]-3-azaspiro[5.5]undecan-3-yl]methyl]azetidin-1-yl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "5-[3-[[9-[4-[[2,6-dimethoxy-4-(2-methyl-1-oxo-2,7-naphthyridin-4-yl)phenyl]methyl]piperazin-1-yl]-3-azaspiro[5.5]undecan-3-yl]methyl]azetidin-1-yl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
298,572
{ "selfies": "[C][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch2][Branch1][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][Br][C][=C][Branch2][Ring1][#Branch1][C][Branch1][C][F][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][P][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring1][=C][F]", "smiles": "CCOCCN(C(=O)c1ccc(F)cc1)c1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2C(F)(F)F)c1F" }
N-[2-bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl]-3-[2-ethoxyethyl-(4-fluorobenzoyl)amino]-2-fluorobenzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "N-[2-bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl]-3-[2-ethoxyethyl-(4-fluorobenzoyl)amino]-2-fluorobenzamide", "role": "assistant" } ]
298,573
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][N][N][=C][Branch2][Ring1][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][P][C][Branch1][Ring1][C][#N][=C][Ring2][Ring1][Branch2][N]", "smiles": "CC(C)(C)n1nc(-c2ccc([N+](=O)[O-])c(OCc3ccccc3)c2)c(C#N)c1N" }
5-amino-1-tert-butyl-3-(4-nitro-3-phenylmethoxyphenyl)pyrazole-4-carbonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "5-amino-1-tert-butyl-3-(4-nitro-3-phenylmethoxyphenyl)pyrazole-4-carbonitrile", "role": "assistant" } ]
298,574
{ "selfies": "[C][=C][Branch1][C][F][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][P][N][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][N][=C][Ring1][#Branch2][Ring2][Ring1][Branch2][C][Ring2][Ring1][N]", "smiles": "C=C(F)C(=O)N1CC(n2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3cc(C(F)(F)F)cnc32)C1" }
3-[1-(2-fluoroprop-2-enoyl)azetidin-3-yl]-6-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "3-[1-(2-fluoroprop-2-enoyl)azetidin-3-yl]-6-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-one", "role": "assistant" } ]
298,576
{ "selfies": "[C][N][C][Branch2][Ring1][=N][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=N][Ring1][#Branch1][N][=C][Ring1][N][C][Branch1][C][F][Branch1][C][F][F][=C][N][=C][Ring2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][O][C][N][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch1]", "smiles": "Cn1c(-c2cn(-c3ccc(N)cn3)nc2C(F)(F)F)cnc1C(=O)Nc1ccc(C(=O)NCC2CC2NC(=O)C2CC(O)CN2)c(Cl)c1" }
5-[1-(5-aminopyridin-2-yl)-3-(trifluoromethyl)pyrazol-4-yl]-N-[3-chloro-4-[[2-[[(2S,4R)-4-hydroxypyrrolidine-2-carbonyl]amino]cyclopropyl]methylcarbamoyl]phenyl]-1-methylimidazole-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "5-[1-(5-aminopyridin-2-yl)-3-(trifluoromethyl)pyrazol-4-yl]-N-[3-chloro-4-[[2-[[(2S,4R)-4-hydroxypyrrolidine-2-carbonyl]amino]cyclopropyl]methylcarbamoyl]phenyl]-1-methylimidazole-2-carboxamide", "role": "assistant" } ]
298,577
{ "selfies": "[C][N][C][Branch2][Ring1][S][C][=C][N][Branch1][#C][C][=N][C][=C][C][Branch1][Branch1][O][C][C][N][=N][Ring1][#Branch2][N][=C][Ring1][#C][C][Branch1][C][F][Branch1][C][F][F][=C][N][=C][Ring2][Ring1][Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][N][C][C][Ring1][=Branch1][C][C][Ring1][=C][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch1]", "smiles": "Cn1c(-c2cn(-c3nccc(OCCN)n3)nc2C(F)(F)F)cnc1C(=O)Nc1ccc(C(=O)N2CCN(C(=O)C3CCNCC3)CC2)c(Cl)c1" }
5-[1-[4-(2-aminoethoxy)pyrimidin-2-yl]-3-(trifluoromethyl)pyrazol-4-yl]-N-[3-chloro-4-[4-(piperidine-4-carbonyl)piperazine-1-carbonyl]phenyl]-1-methylimidazole-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "5-[1-[4-(2-aminoethoxy)pyrimidin-2-yl]-3-(trifluoromethyl)pyrazol-4-yl]-N-[3-chloro-4-[4-(piperidine-4-carbonyl)piperazine-1-carbonyl]phenyl]-1-methylimidazole-2-carboxamide", "role": "assistant" } ]
298,578
{ "selfies": "[C][N][C][Branch2][Ring1][=N][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=N][Ring1][#Branch1][N][=C][Ring1][N][C][Branch1][C][F][Branch1][C][F][F][=C][N][=C][Ring2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][N][Branch1][Ring1][C][Cl][C][Ring1][Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]", "smiles": "Cn1c(-c2cn(-c3ccc(N)cn3)nc2C(F)(F)F)cnc1C(=O)Nc1ccc(C(=O)NC2CC(CN)(CCl)C2)c(Cl)c1" }
N-[4-[[3-(aminomethyl)-3-(chloromethyl)cyclobutyl]carbamoyl]-3-chlorophenyl]-5-[1-(5-aminopyridin-2-yl)-3-(trifluoromethyl)pyrazol-4-yl]-1-methylimidazole-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "N-[4-[[3-(aminomethyl)-3-(chloromethyl)cyclobutyl]carbamoyl]-3-chlorophenyl]-5-[1-(5-aminopyridin-2-yl)-3-(trifluoromethyl)pyrazol-4-yl]-1-methylimidazole-2-carboxamide", "role": "assistant" } ]
298,579
{ "selfies": "[C][C][C][C][N][C][O][C][C][N][C][Branch1][#C][C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][N][Ring1][O][C][N][N][C][C][C][C][Branch1][#Branch1][C][C][Ring1][=Branch1][Ring1][=Branch2][O][Ring2][Ring1][N]", "smiles": "CC1CCNCOCC2NC(CC(N3CCCC3)N2)C2NNC3CCC(CC32)O1" }
(13R)-13-methyl-4-pyrrolidin-1-yl-8,14-dioxa-5,10,19,20,23-pentazatetracyclo[13.5.2.12,6.018,21]tricosane
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(13R)-13-methyl-4-pyrrolidin-1-yl-8,14-dioxa-5,10,19,20,23-pentazatetracyclo[13.5.2.12,6.018,21]tricosane", "role": "assistant" } ]
298,580
{ "selfies": "[C][C][Branch1][C][C][C][C][O][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][N][Branch1][#C][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][Branch1][C][C][C][N][Ring2][Ring1][Branch1][C][Ring2][Ring2][Ring1][=O]", "smiles": "CC(C)CC1ON(C(=O)C=Cc2ccccn2)C2CN(CCC(=O)N3CCNCC3)C(=O)C(CC(C)C)N2C1=O" }
(3R,6S,9aS)-3,6-bis(2-methylpropyl)-8-(3-oxo-3-piperazin-1-ylpropyl)-1-[(E)-3-pyridin-2-ylprop-2-enoyl]-9,9a-dihydro-6H-pyrazino[2,1-c][1,2,4]oxadiazine-4,7-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "(3R,6S,9aS)-3,6-bis(2-methylpropyl)-8-(3-oxo-3-piperazin-1-ylpropyl)-1-[(E)-3-pyridin-2-ylprop-2-enoyl]-9,9a-dihydro-6H-pyrazino[2,1-c][1,2,4]oxadiazine-4,7-dione", "role": "assistant" } ]
298,581
{ "selfies": "[C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][N][=C][Branch2][=Branch1][=N][N][C][=C][C][=C][Branch2][Branch1][S][N][C][C][C][Branch2][Branch1][Ring2][C][N][C][Branch1][C][C][C][N][Branch2][Ring2][Ring1][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][P][=O][C][C][Ring2][Ring1][O][C][C][C][Ring2][Ring2][Ring1][C][=N][Ring2][Ring2][=Branch2][N][=C][Ring2][Ring2][S][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][Ring2][Branch1][#Branch2][=O]", "smiles": "CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCC(CN5C(C)CN(c6cc7c(cc6F)C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5C)CC4)cn3)nc2n(C2CCCC2)c1=O" }
5-[4-[[1-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperidin-4-yl]methyl]-3,5-dimethylpiperazin-1-yl]-2-(2,6-dioxopiperidin-3-yl)-6-fluoroisoindole-1,3-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "5-[4-[[1-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperidin-4-yl]methyl]-3,5-dimethylpiperazin-1-yl]-2-(2,6-dioxopiperidin-3-yl)-6-fluoroisoindole-1,3-dione", "role": "assistant" } ]
298,582
{ "selfies": "[O][=C][C][C][C][Branch2][Ring2][Branch2][N][C][C][=C][Branch2][Ring1][N][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][N][C][C][C][C][Ring1][Branch1][C][N][C][Ring1][#Branch1][C][Ring2][Ring1][Ring2][=O][C][=Branch1][C][=O][N][Ring2][Ring1][N]", "smiles": "O=C1CCC(N2Cc3c(c(F)c(F)c(F)c3N3C4CCC3CNC4)C2=O)C(=O)N1" }
3-[7-[(1S,5R)-3,8-diazabicyclo[3.2.1]octan-8-yl]-4,5,6-trifluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "3-[7-[(1S,5R)-3,8-diazabicyclo[3.2.1]octan-8-yl]-4,5,6-trifluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
298,583
{ "selfies": "[O][=C][C][C][C][Branch2][#Branch1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][S][N][C][C][C][C][N][Branch2][Branch1][Ring1][C][C][C][C][N][Branch2][Ring2][=Branch1][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C][C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][=N][C][Ring2][Ring2][Ring2][C][=C][Ring2][Ring2][O][C][Ring2][Ring2][#C][=O][C][=Branch1][C][=O][N][Ring2][Branch1][#Branch1]", "smiles": "O=C1CCC(N2C(=O)c3ccc(NC4CCCN(CC5CCN(c6ccc(C7c8ccc(O)cc8CCC7c7ccccc7)cc6)CC5)C4)cc3C2=O)C(=O)N1" }
2-(2,6-dioxopiperidin-3-yl)-5-[[(3R)-1-[[1-[4-[(1R,2S)-6-hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]piperidin-4-yl]methyl]piperidin-3-yl]amino]isoindole-1,3-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "2-(2,6-dioxopiperidin-3-yl)-5-[[(3R)-1-[[1-[4-[(1R,2S)-6-hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]piperidin-4-yl]methyl]piperidin-3-yl]amino]isoindole-1,3-dione", "role": "assistant" } ]
298,584
{ "selfies": "[C][C][Branch1][C][C][N][N][=C][Branch2][Branch1][N][N][C][C][C][Branch2][Ring2][S][C][N][C][C][C][C][Branch2][Ring2][Ring1][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][#C][=O][C][Ring2][Ring1][#Branch2][C][C][Ring2][Ring1][P][C][=C][N][=C][Branch2][Ring2][C][N][C][=C][C][=N][C][Branch2][Ring1][=Branch1][C][C][=N][N][Branch1][=N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=Ring1][O][=N][Ring1][P][C][=C][Ring2][Ring1][Branch2][Ring2][Branch1][N]", "smiles": "CC(C)n1nc(N2CCC(CN3CCCC(Nc4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)C3)CC2)c2cnc(Nc3ccnc(-c4cnn(S(=O)(=O)C5CC5)c4)n3)cc21" }
5-[[(3S)-1-[[1-[6-[[2-(1-cyclopropylsulfonylpyrazol-4-yl)pyrimidin-4-yl]amino]-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl]piperidin-4-yl]methyl]piperidin-3-yl]amino]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "5-[[(3S)-1-[[1-[6-[[2-(1-cyclopropylsulfonylpyrazol-4-yl)pyrimidin-4-yl]amino]-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl]piperidin-4-yl]methyl]piperidin-3-yl]amino]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
298,585
{ "selfies": "[C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][S][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][N][=C][N][=C][Ring1][#C][C][=C][Ring2][Ring1][Ring1][O][C][C][C][N][C][C][C][Branch2][Ring2][S][C][N][C][C][C][C][N][Branch2][Ring2][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][#C][=O][C][Ring2][Ring1][=Branch2][C][C][Ring2][Ring1][P]", "smiles": "C=CC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCCCN1CCC(CNC2CCCN(c3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)C2)CC1" }
N-[4-(3-chloro-4-fluoroanilino)-7-[3-[4-[[[(3R)-1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]piperidin-3-yl]amino]methyl]piperidin-1-yl]propoxy]quinazolin-6-yl]prop-2-enamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "N-[4-(3-chloro-4-fluoroanilino)-7-[3-[4-[[[(3R)-1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]piperidin-3-yl]amino]methyl]piperidin-1-yl]propoxy]quinazolin-6-yl]prop-2-enamide", "role": "assistant" } ]
298,586
{ "selfies": "[O][=C][C][C][C][Branch2][Ring1][#C][N][C][C][=C][Branch1][N][N][C][C][C][C][Ring1][Branch1][C][N][Ring1][Branch1][C][=C][C][Branch1][C][F][=C][Ring1][=C][C][Ring1][P][=O][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch2]", "smiles": "O=C1CCC(N2Cc3c(N4CC5CC4CN5)ccc(F)c3C2=O)C(=O)N1" }
3-[7-(2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-fluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "3-[7-(2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-fluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
298,587
{ "selfies": "[C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1][C][=C][C][=C][C][Ring1][=N][C][C][#N]", "smiles": "CC1(c2cccc(I)c2)C=CC=CC1CC#N" }
2-[6-(3-iodophenyl)-6-methylcyclohexa-2,4-dien-1-yl]acetonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2-[6-(3-iodophenyl)-6-methylcyclohexa-2,4-dien-1-yl]acetonitrile", "role": "assistant" } ]
298,588
{ "selfies": "[C][C][C][N][Branch1][Ring1][C][C][C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][S][C][Branch1][Ring1][O][C][=C][Ring1][N]", "smiles": "CCCN(CC)CCc1cc(OC)c(OS)c(OC)c1" }
N-[2-(3,5-dimethoxy-4-sulfanyloxyphenyl)ethyl]-N-ethylpropan-1-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "N-[2-(3,5-dimethoxy-4-sulfanyloxyphenyl)ethyl]-N-ethylpropan-1-amine", "role": "assistant" } ]
298,589
{ "selfies": "[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][Ring2][B][O][C][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][C][Ring1][Branch2][O][Ring2][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Ring1][=C]", "smiles": "Cc1cc(C)c(B2OC(c3ccccc3[N+](=O)[O-])CC3(C=CC=CC=CC3)O2)c(C)c1" }
(4S,6S,7E,9Z,11Z)-4-(2-nitrophenyl)-2-(2,4,6-trimethylphenyl)-1,3-dioxa-2-boraspiro[5.7]trideca-7,9,11-triene
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "(4S,6S,7E,9Z,11Z)-4-(2-nitrophenyl)-2-(2,4,6-trimethylphenyl)-1,3-dioxa-2-boraspiro[5.7]trideca-7,9,11-triene", "role": "assistant" } ]
298,590
{ "selfies": "[C][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Branch1][=N][C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring2][O][N][C][=C][C][Branch1][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][F][=N][N][=C][Ring1][=C][S][C][C][O][Si][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=N][Ring2][Ring1][S][C][Ring2][Ring2][=Branch2]", "smiles": "CN1CC2(C1)CN(CC(=O)Nc1cc(Nc3cc(-c4cc(Cl)ccc4F)nnc3SCCO[Si](C)(C)C(C)(C)C)ccn1)C2" }
N-[4-[[3-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]-6-(5-chloro-2-fluorophenyl)pyridazin-4-yl]amino]pyridin-2-yl]-2-(6-methyl-2,6-diazaspiro[3.3]heptan-2-yl)acetamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "N-[4-[[3-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]-6-(5-chloro-2-fluorophenyl)pyridazin-4-yl]amino]pyridin-2-yl]-2-(6-methyl-2,6-diazaspiro[3.3]heptan-2-yl)acetamide", "role": "assistant" } ]
298,593
{ "selfies": "[C][=C][C][N][=C][Branch1][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Branch1][O][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][Cl][N][Ring2][Ring1][Branch1][C][=C][C][Branch1][C][C][=O]", "smiles": "C=C1CN=C(c2c(F)cccc2F)c2c(ccc(Br)c2Cl)N1C=CC(C)=O" }
(Z)-4-[7-bromo-6-chloro-5-(2,6-difluorophenyl)-2-methylidene-3H-1,4-benzodiazepin-1-yl]but-3-en-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "(Z)-4-[7-bromo-6-chloro-5-(2,6-difluorophenyl)-2-methylidene-3H-1,4-benzodiazepin-1-yl]but-3-en-2-one", "role": "assistant" } ]
298,594
{ "selfies": "[C][C][C][C][C][N][Ring1][Branch1][C][C][O][C][C][C][Ring1][Ring1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]", "smiles": "CC1CCCN1CCOC1CC1(c1ccccc1)c1ccc(Cl)cc1" }
(2R)-1-[2-[2-(4-chlorophenyl)-2-phenylcyclopropyl]oxyethyl]-2-methylpyrrolidine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2R)-1-[2-[2-(4-chlorophenyl)-2-phenylcyclopropyl]oxyethyl]-2-methylpyrrolidine", "role": "assistant" } ]
298,595
{ "selfies": "[C][C][Branch1][C][C][N][C][Branch1][C][C][C][=C][C][=N][O][Ring1][Branch1]", "smiles": "CC(C)NC(C)c1ccno1" }
N-[1-(1,2-oxazol-5-yl)ethyl]propan-2-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "N-[1-(1,2-oxazol-5-yl)ethyl]propan-2-amine", "role": "assistant" } ]
298,596
{ "selfies": "[C][=C][N][=C][C][=Branch1][Ring1][=C][C][C][=C][C][=C][Branch1][C][C][C][Branch1][#Branch2][C][C][Branch1][C][C][C][Ring1][Ring2][C][=C][Ring1][N]", "smiles": "C=CN=CC(=CC)c1ccc(C)c(C2C(C)C2C)c1" }
(Z)-2-[3-(2,3-dimethylcyclopropyl)-4-methylphenyl]-N-ethenylbut-2-en-1-imine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "(Z)-2-[3-(2,3-dimethylcyclopropyl)-4-methylphenyl]-N-ethenylbut-2-en-1-imine", "role": "assistant" } ]
298,597
{ "selfies": "[N][#C][C][=C][C][Branch1][=Branch2][C][C][N][C][C][C][Ring1][Ring1][=C][C][=N][NH1][C][Ring1][Branch1][=C][Ring1][#C]", "smiles": "N#Cc1cc(CCNC2CC2)c2cn[nH]c2c1" }
4-[2-(cyclopropylamino)ethyl]-1H-indazole-6-carbonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "4-[2-(cyclopropylamino)ethyl]-1H-indazole-6-carbonitrile", "role": "assistant" } ]
298,598
{ "selfies": "[F][C][C][C][N][Branch2][Ring2][C][C][=N][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][#Branch2]", "smiles": "FC1CCN(c2nccc(-c3ccccc3)c2-c2nc3c([nH]2)CCCC3)C1" }
2-[2-(3-fluoropyrrolidin-1-yl)-4-phenylpyridin-3-yl]-4,5,6,7-tetrahydro-1H-benzimidazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "2-[2-(3-fluoropyrrolidin-1-yl)-4-phenylpyridin-3-yl]-4,5,6,7-tetrahydro-1H-benzimidazole", "role": "assistant" } ]
298,599
{ "selfies": "[O][=C][Branch1][=C][C][C][C][C][C][N][Ring1][Branch1][C][C][C][Ring1][Branch2][N][C][=C][Branch1][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][=C][N][=C][Ring1][=C][N][C][C][C][Branch1][C][F][C][Ring1][=Branch1]", "smiles": "O=C(CC12CCCN1CCC2)Nc1c(-c2cc(F)ccc2F)ccnc1N1CCC(F)C1" }
N-[4-(2,5-difluorophenyl)-2-(3-fluoropyrrolidin-1-yl)pyridin-3-yl]-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "N-[4-(2,5-difluorophenyl)-2-(3-fluoropyrrolidin-1-yl)pyridin-3-yl]-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide", "role": "assistant" } ]
298,600
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][=C][Branch1][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][=C][N][=C][Ring1][=C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2]", "smiles": "CC(C)(C)NC(=O)Nc1c(-c2cc(F)ccc2F)ccnc1C1CCC(F)(F)CC1" }
1-tert-butyl-3-[2-(4,4-difluorocyclohexyl)-4-(2,5-difluorophenyl)pyridin-3-yl]urea
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "1-tert-butyl-3-[2-(4,4-difluorocyclohexyl)-4-(2,5-difluorophenyl)pyridin-3-yl]urea", "role": "assistant" } ]
298,601
{ "selfies": "[F][C][Branch1][C][F][C][C][Branch1][=C][C][O][C][=N][C][=C][Branch1][C][I][C][=N][Ring1][#Branch1][C][Ring1][=C]", "smiles": "FC1(F)CC(COc2ncc(I)cn2)C1" }
2-[(3,3-difluorocyclobutyl)methoxy]-5-iodopyrimidine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "2-[(3,3-difluorocyclobutyl)methoxy]-5-iodopyrimidine", "role": "assistant" } ]
298,603
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][N][=C][Ring1][=N][C][=C][C][C][C][Ring1][Branch1]", "smiles": "CC(C)(C)OC(=O)c1c(-c2ccccc2F)ccnc1C1=CCCC1" }
tert-butyl 2-(cyclopenten-1-yl)-4-(2-fluorophenyl)pyridine-3-carboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "tert-butyl 2-(cyclopenten-1-yl)-4-(2-fluorophenyl)pyridine-3-carboxylate", "role": "assistant" } ]
298,604
{ "selfies": "[C][N][C][C][C][Branch2][Ring1][P][N][C][=C][C][=C][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=C][Ring2][Ring1][Ring1][Branch2][Ring1][C][C][=N][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][NH1][Ring1][O][C][C][Ring2][Ring2][Branch1]", "smiles": "CN1CCC(Nc2cccc(C(=O)NC3COCc4ccccc43)c2)(c2nc(-c3ccncc3)n[nH]2)CC1" }
N-[(4R)-3,4-dihydro-1H-isochromen-4-yl]-3-[[1-methyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)piperidin-4-yl]amino]benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "N-[(4R)-3,4-dihydro-1H-isochromen-4-yl]-3-[[1-methyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)piperidin-4-yl]amino]benzamide", "role": "assistant" } ]
298,605
{ "selfies": "[C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][N][N][=C][Ring1][#Branch2][O][C][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]", "smiles": "Cc1cc([N+](=O)[O-])c(N)nc1OCCc1ccc([N+](=O)[O-])cc1" }
5-methyl-3-nitro-6-[2-(4-nitrophenyl)ethoxy]pyridin-2-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "5-methyl-3-nitro-6-[2-(4-nitrophenyl)ethoxy]pyridin-2-amine", "role": "assistant" } ]
298,606
{ "selfies": "[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][O][C][=Ring1][Branch1][C][=Branch1][C][=O][O][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1]", "smiles": "CCCCCCCCCCCCCCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CCN(C(=O)OC(C)(C)C)C2" }
6-O-tert-butyl 3-O-ethyl 2-(octadecanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "6-O-tert-butyl 3-O-ethyl 2-(octadecanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate", "role": "assistant" } ]
298,608
{ "selfies": "[C][O][C][=Branch1][C][=O][O][C][=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][C][=C][Branch1][C][F][C][=C][C][Ring1][#Branch1][=C][Ring2][Ring1][Ring2]", "smiles": "COC(=O)Oc1cc(B2OC(C)(C)C(C)(C)O2)c2cc(F)ccc2c1" }
[6-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)naphthalen-2-yl] methyl carbonate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "[6-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)naphthalen-2-yl] methyl carbonate", "role": "assistant" } ]