Friday, December 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methoxy]-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[3-[[2,3-bis(chloranyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-2,6-bis(chloranyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C16H9Cl4N3O2
MOLECULAR WEIGHT: 417.07356
SMILES: C1=CC(=C(C(=C1)Cl)Cl)COC2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=N2
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Product OPENEYE NAME: 2,6-dichloro-4-[3-(1,2-diphenylethoxy)-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-(1,2-diphenylethoxy)-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-(1,2-diphenylethoxy)-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-(1,2-diphenylethoxy)-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C23H17Cl2N3O2
MOLECULAR WEIGHT: 438.30598
SMILES: C1=CC=C(C=C1)CC(C2=CC=CC=C2)OC3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=N3
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[2-(1-naphthyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[2-(1-naphthalenyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-(2-naphthalen-1-ylethoxy)-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-(2-naphthalen-1-ylethoxy)-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H15Cl2N3O2
MOLECULAR WEIGHT: 412.2687
SMILES: C1=CC=C2C(=C1)C=CC=C2CCOC3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=N3
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Product OPENEYE NAME: 4-[3-[bis[3-(trifluoromethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-2,6-dibromo-cyclohexa-2,5-dien-1-one
CAS Name: 4-[3-[bis[3-(trifluoromethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-2,6-dibromo-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-[3-[bis[3-(trifluoromethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-2,6-dibromocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[3-[bis[3-(trifluoromethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-2,6-bis(bromanyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C24H13Br2F6N3O2
MOLECULAR WEIGHT: 649.177339
SMILES: C1=CC(=CC(=C1)C(F)(F)F)C(C2=CC(=CC=C2)C(F)(F)F)OC3=NNC(=C4C=C(C(=O)C(=C4)Br)Br)C=N3
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[2-(4-chlorophenyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[2-(4-chlorophenyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[2-(4-chlorophenyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[2-(4-chlorophenyl)ethoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C17H12Cl3N3O2
MOLECULAR WEIGHT: 396.65508
SMILES: C1=CC(=CC=C1CCOC2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=N2)Cl
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Product OPENEYE NAME: 2,6-dibromo-4-[3-[[4-(morpholinomethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dibromo-4-[3-[[4-(4-morpholinylmethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dibromo-4-[3-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-[3-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H20Br2N4O3
MOLECULAR WEIGHT: 536.2165
SMILES: C1COCCN1CC2=CC=C(C=C2)COC3=NNC(=C4C=C(C(=O)C(=C4)Br)Br)C=N3
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Product OPENEYE NAME: 2-morpholinoethyl 5-[[(2R)-1-[4-(1-hydroxybutyl)phenyl]-5-oxo-pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
CAS Name: 5-[[(2R)-1-[4-(1-hydroxybutyl)phenyl]-5-oxo-2-pyrrolidinyl]methoxymethyl]-2-thiophenecarboxylic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl 5-[[(2R)-1-[4-(1-hydroxybutyl)phenyl]-5-oxopyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl 5-[[(2R)-1-[4-(1-oxidanylbutyl)phenyl]-5-oxidanylidene-pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C27H36N2O6S
MOLECULAR WEIGHT: 516.64954
SMILES: CCCC(C1=CC=C(C=C1)N2[C@H](CCC2=O)COCC3=CC=C(S3)C(=O)OCCN4CCOCC4)O
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Product OPENEYE NAME: 2-hydroxyethyl 5-[[(2R)-1-[4-(1-hydroxypropyl)phenyl]-5-oxo-pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
CAS Name: 5-[[(2R)-1-[4-(1-hydroxypropyl)phenyl]-5-oxo-2-pyrrolidinyl]methoxymethyl]-2-thiophenecarboxylic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl 5-[[(2R)-1-[4-(1-hydroxypropyl)phenyl]-5-oxopyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
SYSTEMATIC NAME: 2-hydroxyethyl 5-[[(2R)-5-oxidanylidene-1-[4-(1-oxidanylpropyl)phenyl]pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C22H27NO6S
MOLECULAR WEIGHT: 433.51788
SMILES: CCC(C1=CC=C(C=C1)N2[C@H](CCC2=O)COCC3=CC=C(S3)C(=O)OCCO)O
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Product OPENEYE NAME: 2-morpholinoethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxo-pyrrolidin-2-yl]propyl]thiophene-2-carboxylate
CAS Name: 5-[3-[(2S)-5-oxo-1-[4-(1-oxohexyl)phenyl]-2-pyrrolidinyl]propyl]-2-thiophenecarboxylic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxopyrrolidin-2-yl]propyl]thiophene-2-carboxylate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxidanylidene-pyrrolidin-2-yl]propyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C30H40N2O5S
MOLECULAR WEIGHT: 540.714
SMILES: CCCCCC(=O)C1=CC=C(C=C1)N2[C@H](CCC2=O)CCCC3=CC=C(S3)C(=O)OCCN4CCOCC4
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Product OPENEYE NAME: 2-hydroxyethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxo-pyrrolidin-2-yl]propyl]thiophene-2-carboxylate
CAS Name: 5-[3-[(2S)-5-oxo-1-[4-(1-oxohexyl)phenyl]-2-pyrrolidinyl]propyl]-2-thiophenecarboxylic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxopyrrolidin-2-yl]propyl]thiophene-2-carboxylate
SYSTEMATIC NAME: 2-hydroxyethyl 5-[3-[(2S)-1-(4-hexanoylphenyl)-5-oxidanylidene-pyrrolidin-2-yl]propyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C26H33NO5S
MOLECULAR WEIGHT: 471.60892
SMILES: CCCCCC(=O)C1=CC=C(C=C1)N2[C@H](CCC2=O)CCCC3=CC=C(S3)C(=O)OCCO
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Product OPENEYE NAME: 2-hydroxyethyl 5-[[(2R)-1-[4-[(1S)-1-hydroxyheptyl]phenyl]-5-oxo-pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
CAS Name: 5-[[(2R)-1-[4-[(1S)-1-hydroxyheptyl]phenyl]-5-oxo-2-pyrrolidinyl]methoxymethyl]-2-thiophenecarboxylic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl 5-[[(2R)-1-[4-[(1S)-1-hydroxyheptyl]phenyl]-5-oxopyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
SYSTEMATIC NAME: 2-hydroxyethyl 5-[[(2R)-1-[4-[(1S)-1-oxidanylheptyl]phenyl]-5-oxidanylidene-pyrrolidin-2-yl]methoxymethyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C26H35NO6S
MOLECULAR WEIGHT: 489.6242
SMILES: CCCCCC[C@@H](C1=CC=C(C=C1)N2[C@H](CCC2=O)COCC3=CC=C(S3)C(=O)OCCO)O
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Product OPENEYE NAME: 3-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-(3,3-diphenylpropyl)-1,2,4-oxadiazole-5-carboxamide
CAS Name: 3-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)-N-(3,3-diphenylpropyl)-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: 3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-N-(3,3-diphenylpropyl)-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-(3,3-diphenylpropyl)-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C24H19Br2N3O3
MOLECULAR WEIGHT: 557.23396
SMILES: C1=CC=C(C=C1)C(CCNC(=O)C2=NC(=C3C=C(C(=O)C(=C3)Br)Br)NO2)C4=CC=CC=C4
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Product OPENEYE NAME: N-benzhydryl-3-(3,5-dichloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
CAS Name: 3-(3,5-dichloro-4-oxo-1-cyclohexa-2,5-dienylidene)-N-(diphenylmethyl)-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: N-benzhydryl-3-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-(diphenylmethyl)-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C22H15Cl2N3O3
MOLECULAR WEIGHT: 440.2788
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=NC(=C4C=C(C(=O)C(=C4)Cl)Cl)NO3
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Product OPENEYE NAME: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C18H9Br2F6N3O3
MOLECULAR WEIGHT: 589.080779
SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CNC(=O)C2=NC(=C3C=C(C(=O)C(=C3)Br)Br)NO2
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Product OPENEYE NAME: 3-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
CAS Name: 3-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: 3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C25H15Br2F6N3O3
MOLECULAR WEIGHT: 679.203319
SMILES: C1=CC(=CC(=C1)C(F)(F)F)CN(CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=NC(=C4C=C(C(=O)C(=C4)Br)Br)NO3
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Product OPENEYE NAME: 3-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-[(3,4-dichlorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
CAS Name: 3-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)-N-[(3,4-dichlorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: 3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-N-[(3,4-dichlorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-[(3,4-dichlorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C16H9Br2Cl2N3O3
MOLECULAR WEIGHT: 521.97496
SMILES: C1=CC(=C(C=C1CNC(=O)C2=NC(=C3C=C(C(=O)C(=C3)Br)Br)NO2)Cl)Cl
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Product OPENEYE NAME: 3-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-[(3-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
CAS Name: 3-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)-N-[(3-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: 3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-N-[(3-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-[(3-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C16H10Br2FN3O3
MOLECULAR WEIGHT: 471.075303
SMILES: C1=CC(=CC(=C1)F)CNC(=O)C2=NC(=C3C=C(C(=O)C(=C3)Br)Br)NO2
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Product OPENEYE NAME: (5E)-2-(4-chlorophenyl)imino-5-[[4-(difluoromethoxy)-3-hydroxy-phenyl]methylene]-3-methyl-thiazolidin-4-one
CAS Name: (5E)-2-(4-chlorophenyl)imino-5-[[4-(difluoromethoxy)-3-hydroxyphenyl]methylidene]-3-methyl-4-thiazolidinone
IUPAC NAME: (5E)-2-(4-chlorophenyl)imino-5-[[4-(difluoromethoxy)-3-hydroxyphenyl]methylidene]-3-methyl-1,3-thiazolidin-4-one
SYSTEMATIC NAME: (5E)-5-[[4-[bis(fluoranyl)methoxy]-3-oxidanyl-phenyl]methylidene]-2-(4-chlorophenyl)imino-3-methyl-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C18H13ClF2N2O3S
MOLECULAR WEIGHT: 410.822226
SMILES: CN1C(=O)/C(=C\C2=CC(=C(C=C2)OC(F)F)O)/SC1=NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (5E)-2-(4-chlorophenyl)imino-5-[(3-hydroxy-4-methoxy-phenyl)methylene]-3-methyl-thiazolidin-4-one
CAS Name: (5E)-2-(4-chlorophenyl)imino-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-3-methyl-4-thiazolidinone
IUPAC NAME: (5E)-2-(4-chlorophenyl)imino-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one
SYSTEMATIC NAME: (5E)-2-(4-chlorophenyl)imino-5-[(4-methoxy-3-oxidanyl-phenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C18H15ClN2O3S
MOLECULAR WEIGHT: 374.8413
SMILES: CN1C(=O)/C(=C\C2=CC(=C(C=C2)OC)O)/SC1=NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [2-acetoxy-4-[(E)-[2-(4-fluorophenyl)imino-3-methyl-4-oxo-thiazolidin-5-ylidene]methyl]phenyl] acetate
CAS Name: acetic acid [2-acetyloxy-4-[(E)-[2-(4-fluorophenyl)imino-3-methyl-4-oxo-5-thiazolidinylidene]methyl]phenyl] ester
IUPAC NAME: [2-acetyloxy-4-[(E)-[2-(4-fluorophenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene]methyl]phenyl] acetate
SYSTEMATIC NAME: [2-acetyloxy-4-[(E)-[2-(4-fluorophenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl] ethanoate
MOLECULAR FORMULA: C21H17FN2O5S
MOLECULAR WEIGHT: 428.433483
SMILES: CC(=O)OC1=C(C=C(C=C1)/C=C/2\C(=O)N(C(=NC3=CC=C(C=C3)F)S2)C)OC(=O)C
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Product OPENEYE NAME: (5E)-2-(4-chlorophenyl)imino-5-[(3,4-dihydroxyphenyl)methylene]-3-[2-(dimethylamino)ethyl]thiazolidin-4-one
CAS Name: (5E)-2-(4-chlorophenyl)imino-5-[(3,4-dihydroxyphenyl)methylidene]-3-[2-(dimethylamino)ethyl]-4-thiazolidinone
IUPAC NAME: (5E)-2-(4-chlorophenyl)imino-5-[(3,4-dihydroxyphenyl)methylidene]-3-[2-(dimethylamino)ethyl]-1,3-thiazolidin-4-one
SYSTEMATIC NAME: (5E)-5-[[3,4-bis(oxidanyl)phenyl]methylidene]-2-(4-chlorophenyl)imino-3-[2-(dimethylamino)ethyl]-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C20H20ClN3O3S
MOLECULAR WEIGHT: 417.9091
SMILES: CN(C)CCN1C(=O)/C(=C\C2=CC(=C(C=C2)O)O)/SC1=NC3=CC=C(C=C3)Cl
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