Tuesday, January 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[(1S)-1-[[3-(ethylcarbamoyl)phenyl]carbamoyl]-2-methyl-propyl]-2-methyl-benzamide
CAS Name: N-[(2S)-1-[3-(ethylcarbamoyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
IUPAC NAME: N-[(2S)-1-[3-(ethylcarbamoyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(2S)-1-[[3-(ethylcarbamoyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide
MOLECULAR FORMULA: C22H27N3O3
MOLECULAR WEIGHT: 381.46808
SMILES: CCNC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2C
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Product OPENEYE NAME: N-ethyl-3-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]benzamide
CAS Name: N-ethyl-3-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-1-oxobutyl]amino]benzamide
IUPAC NAME: N-ethyl-3-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanoyl]amino]benzamide
SYSTEMATIC NAME: N-ethyl-3-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]benzamide
MOLECULAR FORMULA: C21H27N3O5S
MOLECULAR WEIGHT: 433.52118
SMILES: CCNC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-3-[1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propanamide
MOLECULAR FORMULA: C26H28N4O3
MOLECULAR WEIGHT: 444.52552
SMILES: C1CCC2C(C1)C(=O)N(C2=O)CCC(=O)N[C@@H](CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: (2S)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]butan-1-one
CAS Name: (2S)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-1-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-1-butanone
IUPAC NAME: (2S)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]butan-1-one
SYSTEMATIC NAME: (2S)-2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]butan-1-one
MOLECULAR FORMULA: C20H27ClF3N3O2
MOLECULAR WEIGHT: 433.89549
SMILES: CC(C)[C@@H](C(=O)N1CCN(CC1)C(=O)C(C)C)NC2=C(C=C(C=C2)C(F)(F)F)Cl
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Product OPENEYE NAME: (2S)-N-[1-(2-fluorophenyl)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-N-[1-(2-fluorophenyl)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-[1-(2-fluorophenyl)ethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[1-(2-fluorophenyl)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C20H23FN2O3S
MOLECULAR WEIGHT: 390.471623
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC(C)C3=CC=CC=C3F
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Product OPENEYE NAME: N-[(1S)-2-methyl-1-[2-(2-thienyl)ethylcarbamoyl]propyl]furan-2-carboxamide
CAS Name: N-[(2S)-3-methyl-1-oxo-1-(2-thiophen-2-ylethylamino)butan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-3-methyl-1-oxo-1-(2-thiophen-2-ylethylamino)butan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-3-methyl-1-oxidanylidene-1-(2-thiophen-2-ylethylamino)butan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C16H20N2O3S
MOLECULAR WEIGHT: 320.4066
SMILES: CC(C)[C@@H](C(=O)NCCC1=CC=CS1)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: 4-methoxy-N-[(1S)-2-methyl-1-[2-(2-thienyl)ethylcarbamoyl]propyl]benzamide
CAS Name: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(2-thiophen-2-ylethylamino)butan-2-yl]benzamide
IUPAC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(2-thiophen-2-ylethylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxidanylidene-1-(2-thiophen-2-ylethylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C19H24N2O3S
MOLECULAR WEIGHT: 360.47046
SMILES: CC(C)[C@@H](C(=O)NCCC1=CC=CS1)NC(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1S)-1-[1-(4-ethylphenyl)ethylcarbamoyl]-2-methyl-propyl]-2-methyl-benzamide
CAS Name: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
IUPAC NAME: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide
MOLECULAR FORMULA: C23H30N2O2
MOLECULAR WEIGHT: 366.4965
SMILES: CCC1=CC=C(C=C1)C(C)NC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2C
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Product OPENEYE NAME: 2-chloro-N-[(1S)-2-[1-(4-ethylphenyl)ethylamino]-1-methyl-2-oxo-ethyl]benzamide
CAS Name: 2-chloro-N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxopropan-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxopropan-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]benzamide
MOLECULAR FORMULA: C20H23ClN2O2
MOLECULAR WEIGHT: 358.86182
SMILES: CCC1=CC=C(C=C1)C(C)NC(=O)[C@H](C)NC(=O)C2=CC=CC=C2Cl
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Product OPENEYE NAME: N-[(1S)-2-[1-(4-ethylphenyl)ethylamino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[1-(4-ethylphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C18H22N2O3
MOLECULAR WEIGHT: 314.37888
SMILES: CCC1=CC=C(C=C1)C(C)NC(=O)[C@H](C)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]butanamide
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]butanamide
IUPAC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]butanamide
SYSTEMATIC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-N-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]butanamide
MOLECULAR FORMULA: C23H30FN3O4S
MOLECULAR WEIGHT: 463.565403
SMILES: CC1=CC(=C(C(=C1)C)NC(=O)CN(C)C(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CC=C2F)C
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Product OPENEYE NAME: N-[(1S)-1-benzyl-2-[1-(2-fluorophenyl)ethylamino]-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C22H21FN2O3
MOLECULAR WEIGHT: 380.412143
SMILES: CC(C1=CC=CC=C1F)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CO3
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Product OPENEYE NAME: 2-fluoro-N-[(1S)-1-[1-(2-fluorophenyl)ethylcarbamoyl]-2-methyl-propyl]benzamide
CAS Name: 2-fluoro-N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]benzamide
IUPAC NAME: 2-fluoro-N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]benzamide
SYSTEMATIC NAME: 2-fluoranyl-N-[(2S)-1-[1-(2-fluorophenyl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide
MOLECULAR FORMULA: C20H22F2N2O2
MOLECULAR WEIGHT: 360.397686
SMILES: CC(C)[C@@H](C(=O)NC(C)C1=CC=CC=C1F)NC(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-phenylsulfanyl-propanamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(phenylthio)propanamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-phenylsulfanylpropanamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-phenylsulfanyl-propanamide
MOLECULAR FORMULA: C24H23N3OS
MOLECULAR WEIGHT: 401.52392
SMILES: CC(C(=O)N[C@@H](CC1=CC=CC=C1)C2=NC3=CC=CC=C3N2)SC4=CC=CC=C4
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-(4-ethyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl)acetamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(4-ethyl-2,5-dioxo-4-phenyl-1-imidazolidinyl)acetamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-[4-ethyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]ethanamide
MOLECULAR FORMULA: C28H27N5O3
MOLECULAR WEIGHT: 481.54568
SMILES: CCC1(C(=O)N(C(=O)N1)CC(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5
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Product OPENEYE NAME: (2S)-N-[1-(2-naphthyl)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-N-[1-(2-naphthalenyl)ethyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-(4-methylphenyl)sulfonyl-N-(1-naphthalen-2-ylethyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-(4-methylphenyl)sulfonyl-N-(1-naphthalen-2-ylethyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C24H26N2O3S
MOLECULAR WEIGHT: 422.53984
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC(C)C3=CC4=CC=CC=C4C=C3
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Product OPENEYE NAME: N-[(1S)-1-(1,3-benzothiazol-2-ylcarbamoyl)-2-methyl-propyl]-2-methyl-benzamide
CAS Name: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
IUPAC NAME: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide
MOLECULAR FORMULA: C20H21N3O2S
MOLECULAR WEIGHT: 367.46464
SMILES: CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NC2=NC3=CC=CC=C3S2
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