Tuesday, January 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: methyl (2R)-2-[3-(benzenesulfonamido)propanoylamino]-3-(1H-indol-3-yl)propanoate
CAS Name: (2R)-2-[[3-(benzenesulfonamido)-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester
IUPAC NAME: methyl (2R)-2-[3-(benzenesulfonamido)propanoylamino]-3-(1H-indol-3-yl)propanoate
SYSTEMATIC NAME: methyl (2R)-3-(1H-indol-3-yl)-2-[3-(phenylsulfonylamino)propanoylamino]propanoate
MOLECULAR FORMULA: C21H23N3O5S
MOLECULAR WEIGHT: 429.48942
SMILES: COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2S)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,3-dimethyl-2-(p-tolylsulfonylamino)butanamide
CAS Name: (2S)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,3-dimethyl-2-[(4-methylphenyl)sulfonylamino]butanamide
IUPAC NAME: (2S)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,3-dimethyl-2-[(4-methylphenyl)sulfonylamino]butanamide
SYSTEMATIC NAME: (2S)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,3-dimethyl-2-[(4-methylphenyl)sulfonylamino]butanamide
MOLECULAR FORMULA: C22H28N2O5S
MOLECULAR WEIGHT: 432.53312
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)N(C)CC2COC3=CC=CC=C3O2
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Product OPENEYE NAME: N-[(1S)-1-[(2-hydroxy-5-nitro-phenyl)methylcarbamoyl]-2-methyl-propyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[(2-hydroxy-5-nitrophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[(2-hydroxy-5-nitrophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-3-methyl-1-[(5-nitro-2-oxidanyl-phenyl)methylamino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C17H19N3O6
MOLECULAR WEIGHT: 361.34926
SMILES: CC(C)[C@@H](C(=O)NCC1=C(C=CC(=C1)[N+](=O)[O-])O)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-methyl-2-morpholino-propyl)butanamide
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-[2-methyl-2-(4-morpholinyl)propyl]butanamide
IUPAC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)butanamide
SYSTEMATIC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-methyl-2-morpholin-4-yl-propyl)butanamide
MOLECULAR FORMULA: C19H30FN3O4S
MOLECULAR WEIGHT: 415.522603
SMILES: CC(C)[C@@H](C(=O)NCC(C)(C)N1CCOCC1)NS(=O)(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: N-[(1S)-1-benzyl-2-[2-[2-(2,3-dimethylphenoxy)propanoyl]hydrazino]-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[[2-(2,3-dimethylphenoxy)-1-oxopropyl]hydrazo]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[2-[2-(2,3-dimethylphenoxy)propanoyl]hydrazinyl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[2-[2-(2,3-dimethylphenoxy)propanoyl]hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C25H27N3O5
MOLECULAR WEIGHT: 449.49898
SMILES: CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CO3)C
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Product OPENEYE NAME: N-[(1S)-1-benzyl-2-[(2-methyl-2-morpholino-propyl)amino]-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[[2-methyl-2-(4-morpholinyl)propyl]amino]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[(2-methyl-2-morpholin-4-ylpropyl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[(2-methyl-2-morpholin-4-yl-propyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C22H29N3O4
MOLECULAR WEIGHT: 399.48336
SMILES: CC(C)(CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=CO2)N3CCOCC3
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Product OPENEYE NAME: (2S)-N-[(1-morpholinocyclohexyl)methyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-N-[[1-(4-morpholinyl)cyclohexyl]methyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-(4-methylphenyl)sulfonyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-(4-methylphenyl)sulfonyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C23H35N3O4S
MOLECULAR WEIGHT: 449.6067
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC3(CCCCC3)N4CCOCC4
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Product OPENEYE NAME: (2S)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C25H33N3O4S
MOLECULAR WEIGHT: 471.61222
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC(C3=CC(=CC=C3)OC)N4CCCC4
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Product OPENEYE NAME: N-[(1S)-1-benzyl-2-[1-(4-imidazol-1-ylphenyl)ethylamino]-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[1-[4-(1-imidazolyl)phenyl]ethylamino]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[1-(4-imidazol-1-ylphenyl)ethylamino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[1-(4-imidazol-1-ylphenyl)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C25H24N4O3
MOLECULAR WEIGHT: 428.48306
SMILES: CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CO4
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Product OPENEYE NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-butanamide
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-methylbutanamide
IUPAC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-methylbutanamide
SYSTEMATIC NAME: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-butanamide
MOLECULAR FORMULA: C24H32FN3O4S
MOLECULAR WEIGHT: 477.591983
SMILES: CC(C)[C@@H](C(=O)NCC(C1=CC(=CC=C1)OC)N2CCCC2)NS(=O)(=O)C3=CC=CC=C3F
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Product OPENEYE NAME: 3-methyl-N-[(1S)-2-methyl-1-(2-phenylpropylcarbamoyl)propyl]benzamide
CAS Name: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-(2-phenylpropylamino)butan-2-yl]benzamide
IUPAC NAME: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-(2-phenylpropylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(2-phenylpropylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C22H28N2O2
MOLECULAR WEIGHT: 352.46992
SMILES: CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NCC(C)C2=CC=CC=C2
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Product OPENEYE NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-methyl-butanamide
CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methylbutanamide
IUPAC NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methylbutanamide
SYSTEMATIC NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-methyl-butanamide
MOLECULAR FORMULA: C19H26BrN3O3S2
MOLECULAR WEIGHT: 488.46204
SMILES: CC(C)[C@@H](C(=O)NCC(C1=CC=CS1)N(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: (2S)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-methyl-2-(p-tolylsulfonylamino)butanamide
CAS Name: (2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
IUPAC NAME: (2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
SYSTEMATIC NAME: (2S)-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
MOLECULAR FORMULA: C20H29N3O3S2
MOLECULAR WEIGHT: 423.59256
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NCC(C2=CC=CS2)N(C)C
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