Tuesday, January 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2S)-N-[(4-bromophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-butanamide
CAS Name: (2S)-N-[(4-bromophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethylbutanamide
IUPAC NAME: (2S)-N-[(4-bromophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethylbutanamide
SYSTEMATIC NAME: (2S)-N-[(4-bromophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-butanamide
MOLECULAR FORMULA: C19H22BrFN2O3S
MOLECULAR WEIGHT: 457.356983
SMILES: CC(C)[C@@H](C(=O)N(C)CC1=CC=C(C=C1)Br)NS(=O)(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: N-[(1S)-2-[(4-bromophenyl)methyl-methyl-amino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[(4-bromophenyl)methyl-methylamino]-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[(4-bromophenyl)methyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[(4-bromophenyl)methyl-methyl-amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C16H17BrN2O3
MOLECULAR WEIGHT: 365.22178
SMILES: C[C@@H](C(=O)N(C)CC1=CC=C(C=C1)Br)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: 2-chloro-N-[(1S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)propyl]benzamide
CAS Name: 2-chloro-N-[(2S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)butan-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[(2S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C23H25ClN2O4
MOLECULAR WEIGHT: 428.9086
SMILES: CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC3(O2)CCCC3)NC(=O)C4=CC=CC=C4Cl
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Product OPENEYE NAME: 4-fluoro-N-[(1S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)propyl]benzamide
CAS Name: 4-fluoro-N-[(2S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)butan-2-yl]benzamide
IUPAC NAME: 4-fluoro-N-[(2S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 4-fluoranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C23H25FN2O4
MOLECULAR WEIGHT: 412.454003
SMILES: CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC3(O2)CCCC3)NC(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 3-methyl-N-[(1S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)propyl]benzamide
CAS Name: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)butan-2-yl]benzamide
IUPAC NAME: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C24H28N2O4
MOLECULAR WEIGHT: 408.49012
SMILES: CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4
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Product OPENEYE NAME: 3-(diethylsulfamoyl)-N-[(1S)-2-methyl-1-[1-(2-thienyl)ethylcarbamoyl]propyl]benzamide
CAS Name: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxo-1-(1-thiophen-2-ylethylamino)butan-2-yl]benzamide
IUPAC NAME: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxo-1-(1-thiophen-2-ylethylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-(1-thiophen-2-ylethylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C22H31N3O4S2
MOLECULAR WEIGHT: 465.62924
SMILES: CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C2=CC=CS2
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Product OPENEYE NAME: (2S)-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-butanamide
CAS Name: (2S)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethylbutanamide
IUPAC NAME: (2S)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethylbutanamide
SYSTEMATIC NAME: (2S)-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-[(2-fluorophenyl)sulfonylamino]-N,3-dimethyl-butanamide
MOLECULAR FORMULA: C22H28FN3O4S
MOLECULAR WEIGHT: 449.538823
SMILES: CC1=C(C(=CC=C1)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-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-6-chloro-pyridine-3-carboxamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-6-chloro-3-pyridinecarboxamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-6-chloropyridine-3-carboxamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-6-chloranyl-pyridine-3-carboxamide
MOLECULAR FORMULA: C21H17ClN4O
MOLECULAR WEIGHT: 376.83888
SMILES: C1=CC=C(C=C1)C[C@@H](C2=NC3=CC=CC=C3N2)NC(=O)C4=CN=C(C=C4)Cl
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Product OPENEYE NAME: 2-chloro-N-[(1S)-2-[1-(3-chlorophenyl)ethylamino]-1-methyl-2-oxo-ethyl]benzamide
CAS Name: 2-chloro-N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxopropan-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxopropan-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl]benzamide
MOLECULAR FORMULA: C18H18Cl2N2O2
MOLECULAR WEIGHT: 365.25372
SMILES: C[C@@H](C(=O)NC(C)C1=CC(=CC=C1)Cl)NC(=O)C2=CC=CC=C2Cl
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Product OPENEYE NAME: N-[(1S)-2-[1-(3-chlorophenyl)ethylamino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[1-(3-chlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C16H17ClN2O3
MOLECULAR WEIGHT: 320.77078
SMILES: C[C@@H](C(=O)NC(C)C1=CC(=CC=C1)Cl)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: 2,6-difluoro-N-[(1S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)propyl]benzamide
CAS Name: 2,6-difluoro-N-[(2S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)butan-2-yl]benzamide
IUPAC NAME: 2,6-difluoro-N-[(2S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 2,6-bis(fluoranyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C23H24F2N2O4
MOLECULAR WEIGHT: 430.444466
SMILES: CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC3(O2)CCCC3)NC(=O)C4=C(C=CC=C4F)F
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Product OPENEYE NAME: N-[(1S,2S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)butyl]benzamide
CAS Name: N-[(2S,3S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)pentan-2-yl]benzamide
IUPAC NAME: N-[(2S,3S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)pentan-2-yl]benzamide
SYSTEMATIC NAME: N-[(2S,3S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)pentan-2-yl]benzamide
MOLECULAR FORMULA: C24H28N2O4
MOLECULAR WEIGHT: 408.49012
SMILES: CC[C@H](C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC3(O2)CCCC3)NC(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 4-methoxy-N-[(1S)-2-methyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylcarbamoyl)propyl]benzamide
CAS Name: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)butan-2-yl]benzamide
IUPAC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxidanylidene-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C24H28N2O5
MOLECULAR WEIGHT: 424.48952
SMILES: CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC3(O2)CCCC3)NC(=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-norbornan-2-yl-acetamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(3-bicyclo[2.2.1]heptanyl)acetamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(3-bicyclo[2.2.1]heptanyl)acetamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-(3-bicyclo[2.2.1]heptanyl)ethanamide
MOLECULAR FORMULA: C24H27N3O
MOLECULAR WEIGHT: 373.49068
SMILES: C1CC2CC1CC2CC(=O)N[C@@H](CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5,6-dichloro-pyridine-3-carboxamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-5,6-dichloro-3-pyridinecarboxamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-5,6-dichloropyridine-3-carboxamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5,6-bis(chloranyl)pyridine-3-carboxamide
MOLECULAR FORMULA: C21H16Cl2N4O
MOLECULAR WEIGHT: 411.28394
SMILES: C1=CC=C(C=C1)C[C@@H](C2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=C(N=C4)Cl)Cl
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Product OPENEYE NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[1-(2-thienyl)ethyl]butanamide
CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-(1-thiophen-2-ylethyl)butanamide
IUPAC NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-(1-thiophen-2-ylethyl)butanamide
SYSTEMATIC NAME: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-(1-thiophen-2-ylethyl)butanamide
MOLECULAR FORMULA: C17H21BrN2O3S2
MOLECULAR WEIGHT: 445.39424
SMILES: CC(C)[C@@H](C(=O)NC(C)C1=CC=CS1)NS(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: 2-chloro-N-[(1S)-1-methyl-2-oxo-2-[1-(2-thienyl)ethylamino]ethyl]benzamide
CAS Name: 2-chloro-N-[(2S)-1-oxo-1-(1-thiophen-2-ylethylamino)propan-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[(2S)-1-oxo-1-(1-thiophen-2-ylethylamino)propan-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-1-oxidanylidene-1-(1-thiophen-2-ylethylamino)propan-2-yl]benzamide
MOLECULAR FORMULA: C16H17ClN2O2S
MOLECULAR WEIGHT: 336.83638
SMILES: C[C@@H](C(=O)NC(C)C1=CC=CS1)NC(=O)C2=CC=CC=C2Cl
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide
MOLECULAR FORMULA: C28H27FN4O2
MOLECULAR WEIGHT: 470.537983
SMILES: C1CN(CCC1C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)F
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Product OPENEYE NAME: 4-amino-N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-3-nitro-benzamide
CAS Name: 4-amino-N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-3-nitrobenzamide
IUPAC NAME: 4-amino-N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-3-nitrobenzamide
SYSTEMATIC NAME: 4-azanyl-N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-3-nitro-benzamide
MOLECULAR FORMULA: C22H19N5O3
MOLECULAR WEIGHT: 401.41796
SMILES: C1=CC=C(C=C1)C[C@@H](C2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=C(C=C4)N)[N+](=O)[O-]
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-chlorobenzoyl)piperidine-3-carboxamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-[(4-chlorophenyl)-oxomethyl]-3-piperidinecarboxamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-(4-chlorobenzoyl)piperidine-3-carboxamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-chlorophenyl)carbonyl-piperidine-3-carboxamide
MOLECULAR FORMULA: C28H27ClN4O2
MOLECULAR WEIGHT: 486.99258
SMILES: C1CC(CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)N[C@@H](CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: N-[(1S)-1-(4-benzoylpiperazine-1-carbonyl)-2-methyl-propyl]-2-methyl-benzamide
CAS Name: N-[(2S)-1-(4-benzoyl-1-piperazinyl)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
IUPAC NAME: N-[(2S)-1-(4-benzoylpiperazin-1-yl)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
SYSTEMATIC NAME: 2-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(phenylcarbonyl)piperazin-1-yl]butan-2-yl]benzamide
MOLECULAR FORMULA: C24H29N3O3
MOLECULAR WEIGHT: 407.50536
SMILES: CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2S)-N-[(4-carbamoylphenyl)methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-N-[(4-carbamoylphenyl)methyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-[(4-carbamoylphenyl)methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[(4-aminocarbonylphenyl)methyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C18H19N3O3S
MOLECULAR WEIGHT: 357.42676
SMILES: C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)NCC3=CC=C(C=C3)C(=O)N
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