Friday, March 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1S)-2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2S)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2S)-1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C21H19ClN2O5
MOLECULAR WEIGHT: 414.83896
SMILES: C[C@@H](C(=O)NCC1=CC=CC=C1Cl)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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Product OPENEYE NAME: [2-(4-ethylphenyl)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(4-ethylphenyl)-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C22H21NO4S
MOLECULAR WEIGHT: 395.47144
SMILES: CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2OCC3=CSC(=N3)C
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Product OPENEYE NAME: (4-methoxycarbonyl-5-methyl-2-furyl)methyl 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (4-methoxycarbonyl-5-methyl-2-furanyl)methyl ester
IUPAC NAME: (4-methoxycarbonyl-5-methylfuran-2-yl)methyl 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: (4-methoxycarbonyl-5-methyl-furan-2-yl)methyl 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C20H21NO6
MOLECULAR WEIGHT: 371.38384
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC3=CC(=C(O3)C)C(=O)OC
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Product OPENEYE NAME: [2-(2-acetylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(2-acetylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-acetylanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H22N2O5
MOLECULAR WEIGHT: 394.42048
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)NC3=CC=CC=C3C(=O)C
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Product OPENEYE NAME: [(1R)-2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C21H19ClN2O5
MOLECULAR WEIGHT: 414.83896
SMILES: C[C@H](C(=O)NCC1=CC=CC=C1Cl)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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Product OPENEYE NAME: [2-(2-methoxyphenyl)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C21H19NO5S
MOLECULAR WEIGHT: 397.44426
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC(=O)C3=CC=CC=C3OC
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Product OPENEYE NAME: [2-oxo-2-(2-thienylmethylamino)ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester
IUPAC NAME: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C19H20N2O4S
MOLECULAR WEIGHT: 372.4381
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)NCC3=CC=CS3
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Product OPENEYE NAME: [(1S)-2-(3,4-difluoroanilino)-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2S)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2S)-1-[[3,4-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C20H16F2N2O5
MOLECULAR WEIGHT: 402.348246
SMILES: C[C@@H](C(=O)NC1=CC(=C(C=C1)F)F)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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Product OPENEYE NAME: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-difluorophenyl)-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C20H15F2NO4S
MOLECULAR WEIGHT: 403.399206
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC(=O)C3=CC(=C(C=C3)F)F
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Product OPENEYE NAME: [(1R)-2-(3,4-difluoroanilino)-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2R)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2R)-1-[[3,4-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C20H16F2N2O5
MOLECULAR WEIGHT: 402.348246
SMILES: C[C@H](C(=O)NC1=CC(=C(C=C1)F)F)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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Product OPENEYE NAME: (5-acetyl-2-methoxy-phenyl)methyl 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid (5-acetyl-2-methoxyphenyl)methyl ester
IUPAC NAME: (5-acetyl-2-methoxyphenyl)methyl 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: (5-ethanoyl-2-methoxy-phenyl)methyl 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C22H21NO5S
MOLECULAR WEIGHT: 411.47084
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC
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Product OPENEYE NAME: [2-(3,4-dimethoxyphenyl)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dimethoxyphenyl)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H23NO6
MOLECULAR WEIGHT: 397.42112
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: [(1R)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2R)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2R)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C22H22N2O6
MOLECULAR WEIGHT: 410.41988
SMILES: CCOC1=CC=CC=C1NC(=O)[C@@H](C)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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Product OPENEYE NAME: [2-(isopropylamino)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester
IUPAC NAME: [2-oxo-2-(propan-2-ylamino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C17H20N2O4S
MOLECULAR WEIGHT: 348.4167
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC(=O)NC(C)C
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Product OPENEYE NAME: (2-nitrophenyl)methyl 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (2-nitrophenyl)methyl ester
IUPAC NAME: (2-nitrophenyl)methyl 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: (2-nitrophenyl)methyl 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C19H18N2O5
MOLECULAR WEIGHT: 354.35662
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]
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Product OPENEYE NAME: [(1S)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 4-(2,5-dioxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C22H22N2O6
MOLECULAR WEIGHT: 410.41988
SMILES: CCOC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O
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