Thursday, May 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[(1R)-1-(4-chlorophenyl)-2-methyl-propyl]-2-[2-(methanesulfonamido)thiazol-4-yl]acetamide
CAS Name: N-[(1R)-1-(4-chlorophenyl)-2-methylpropyl]-2-[2-(methanesulfonamido)-4-thiazolyl]acetamide
IUPAC NAME: N-[(1R)-1-(4-chlorophenyl)-2-methylpropyl]-2-[2-(methanesulfonamido)-1,3-thiazol-4-yl]acetamide
SYSTEMATIC NAME: N-[(1R)-1-(4-chlorophenyl)-2-methyl-propyl]-2-[2-(methylsulfonylamino)-1,3-thiazol-4-yl]ethanamide
MOLECULAR FORMULA: C16H20ClN3O3S2
MOLECULAR WEIGHT: 401.9313
SMILES: CC(C)[C@H](C1=CC=C(C=C1)Cl)NC(=O)CC2=CSC(=N2)NS(=O)(=O)C
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Product OPENEYE NAME: N-[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]-2-[2-(methanesulfonamido)thiazol-4-yl]acetamide
CAS Name: N-[(1S)-1-(4-chlorophenyl)-2-methylpropyl]-2-[2-(methanesulfonamido)-4-thiazolyl]acetamide
IUPAC NAME: N-[(1S)-1-(4-chlorophenyl)-2-methylpropyl]-2-[2-(methanesulfonamido)-1,3-thiazol-4-yl]acetamide
SYSTEMATIC NAME: N-[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]-2-[2-(methylsulfonylamino)-1,3-thiazol-4-yl]ethanamide
MOLECULAR FORMULA: C16H20ClN3O3S2
MOLECULAR WEIGHT: 401.9313
SMILES: CC(C)[C@@H](C1=CC=C(C=C1)Cl)NC(=O)CC2=CSC(=N2)NS(=O)(=O)C
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Product OPENEYE NAME: 5-[(2S)-2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CAS Name: 5-[[(2S)-2-(3-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-1H-pyridin-2-one
IUPAC NAME: 5-[(2S)-2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
SYSTEMATIC NAME: 5-[(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]carbonyl-1H-pyridin-2-one
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: COC1=CC=CC(=C1)[C@@H]2CCCN2C(=O)C3=CNC(=O)C=C3
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Product OPENEYE NAME: 5-[(2R)-2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CAS Name: 5-[[(2R)-2-(3-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-1H-pyridin-2-one
IUPAC NAME: 5-[(2R)-2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
SYSTEMATIC NAME: 5-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]carbonyl-1H-pyridin-2-one
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: COC1=CC=CC(=C1)[C@H]2CCCN2C(=O)C3=CNC(=O)C=C3
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Product OPENEYE NAME: [(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
CAS Name: [(2S)-2-(3-methoxyphenyl)-1-pyrrolidinyl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
IUPAC NAME: [(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
SYSTEMATIC NAME: [(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
MOLECULAR FORMULA: C18H19N5O2
MOLECULAR WEIGHT: 337.37576
SMILES: CC1=CC=NC2=NC(=NN12)C(=O)N3CCC[C@H]3C4=CC(=CC=C4)OC
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Product OPENEYE NAME: [(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
CAS Name: [(2R)-2-(3-methoxyphenyl)-1-pyrrolidinyl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
IUPAC NAME: [(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
SYSTEMATIC NAME: [(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanone
MOLECULAR FORMULA: C18H19N5O2
MOLECULAR WEIGHT: 337.37576
SMILES: CC1=CC=NC2=NC(=NN12)C(=O)N3CCC[C@@H]3C4=CC(=CC=C4)OC
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Product OPENEYE NAME: (2R)-N-[6-(dimethylamino)-3-pyridyl]-2-phenyl-butanamide
CAS Name: (2R)-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylbutanamide
IUPAC NAME: (2R)-N-[6-(dimethylamino)pyridin-3-yl]-2-phenylbutanamide
SYSTEMATIC NAME: (2R)-N-[6-(dimethylamino)pyridin-3-yl]-2-phenyl-butanamide
MOLECULAR FORMULA: C17H21N3O
MOLECULAR WEIGHT: 283.36814
SMILES: CC[C@H](C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N(C)C
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Product OPENEYE NAME: (2S)-N-[6-(dimethylamino)-3-pyridyl]-2-phenyl-butanamide
CAS Name: (2S)-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylbutanamide
IUPAC NAME: (2S)-N-[6-(dimethylamino)pyridin-3-yl]-2-phenylbutanamide
SYSTEMATIC NAME: (2S)-N-[6-(dimethylamino)pyridin-3-yl]-2-phenyl-butanamide
MOLECULAR FORMULA: C17H21N3O
MOLECULAR WEIGHT: 283.36814
SMILES: CC[C@@H](C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N(C)C
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Product OPENEYE NAME: 2,3-dimethyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)benzamide
CAS Name: 2,3-dimethyl-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]benzamide
IUPAC NAME: 2,3-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide
SYSTEMATIC NAME: 2,3-dimethyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)benzamide
MOLECULAR FORMULA: C15H20N2O2
MOLECULAR WEIGHT: 260.3315
SMILES: CC1=CC=CC(=C1C)C(=O)NCC(=O)N2CCCC2
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Product OPENEYE NAME: 2,5-dimethyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)thiophene-3-carboxamide
CAS Name: 2,5-dimethyl-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-thiophenecarboxamide
IUPAC NAME: 2,5-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)thiophene-3-carboxamide
SYSTEMATIC NAME: 2,5-dimethyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)thiophene-3-carboxamide
MOLECULAR FORMULA: C13H18N2O2S
MOLECULAR WEIGHT: 266.35922
SMILES: CC1=CC(=C(S1)C)C(=O)NCC(=O)N2CCCC2
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Product OPENEYE NAME: N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-2-(p-tolyl)acetamide
CAS Name: 2-(4-methylphenyl)-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]acetamide
IUPAC NAME: 2-(4-methylphenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SYSTEMATIC NAME: 2-(4-methylphenyl)-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)ethanamide
MOLECULAR FORMULA: C15H20N2O2
MOLECULAR WEIGHT: 260.3315
SMILES: CC1=CC=C(C=C1)CC(=O)NCC(=O)N2CCCC2
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Product OPENEYE NAME: N-(2-oxo-2-pyrrolidin-1-yl-ethyl)quinoline-5-carboxamide
CAS Name: N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-quinolinecarboxamide
IUPAC NAME: N-(2-oxo-2-pyrrolidin-1-ylethyl)quinoline-5-carboxamide
SYSTEMATIC NAME: N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)quinoline-5-carboxamide
MOLECULAR FORMULA: C16H17N3O2
MOLECULAR WEIGHT: 283.32508
SMILES: C1CCN(C1)C(=O)CNC(=O)C2=C3C=CC=NC3=CC=C2
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Product OPENEYE NAME: 3-[3-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-3-oxo-propyl]thiazolidin-2-one
CAS Name: 3-[3-[2-(cyclohexylamino)-4-methyl-1-pyridin-1-iumyl]-3-oxopropyl]-2-thiazolidinone
IUPAC NAME: 3-[3-[2-(cyclohexylamino)-4-methylpyridin-1-ium-1-yl]-3-oxopropyl]-1,3-thiazolidin-2-one
SYSTEMATIC NAME: 3-[3-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-3-oxidanylidene-propyl]-1,3-thiazolidin-2-one
MOLECULAR FORMULA: C18H26N3O2S+
MOLECULAR WEIGHT: 348.48294
SMILES: CC1=CC(=[N+](C=C1)C(=O)CCN2CCSC2=O)NC3CCCCC3
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Product OPENEYE NAME: cyclohexyl-[[2-[[2-(4-fluorophenyl)acetyl]amino]phenyl]methyl]-methyl-ammonium
CAS Name: cyclohexyl-[[2-[[2-(4-fluorophenyl)-1-oxoethyl]amino]phenyl]methyl]-methylammonium
IUPAC NAME: cyclohexyl-[[2-[[2-(4-fluorophenyl)acetyl]amino]phenyl]methyl]-methylazanium
SYSTEMATIC NAME: cyclohexyl-[[2-[2-(4-fluorophenyl)ethanoylamino]phenyl]methyl]-methyl-azanium
MOLECULAR FORMULA: C22H28FN2O+
MOLECULAR WEIGHT: 355.468923
SMILES: C[NH+](CC1=CC=CC=C1NC(=O)CC2=CC=C(C=C2)F)C3CCCCC3
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Product OPENEYE NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(4-fluorophenyl)acetamide
CAS Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(4-fluorophenyl)acetamide
IUPAC NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(4-fluorophenyl)acetamide
SYSTEMATIC NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(4-fluorophenyl)ethanamide
MOLECULAR FORMULA: C22H27FN2O
MOLECULAR WEIGHT: 354.460983
SMILES: CN(CC1=CC=CC=C1NC(=O)CC2=CC=C(C=C2)F)C3CCCCC3
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Product OPENEYE NAME: cyclohexyl-[[2-[[2-(2-fluorophenyl)acetyl]amino]phenyl]methyl]-methyl-ammonium
CAS Name: cyclohexyl-[[2-[[2-(2-fluorophenyl)-1-oxoethyl]amino]phenyl]methyl]-methylammonium
IUPAC NAME: cyclohexyl-[[2-[[2-(2-fluorophenyl)acetyl]amino]phenyl]methyl]-methylazanium
SYSTEMATIC NAME: cyclohexyl-[[2-[2-(2-fluorophenyl)ethanoylamino]phenyl]methyl]-methyl-azanium
MOLECULAR FORMULA: C22H28FN2O+
MOLECULAR WEIGHT: 355.468923
SMILES: C[NH+](CC1=CC=CC=C1NC(=O)CC2=CC=CC=C2F)C3CCCCC3
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Product OPENEYE NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(2-fluorophenyl)acetamide
CAS Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(2-fluorophenyl)acetamide
IUPAC NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(2-fluorophenyl)acetamide
SYSTEMATIC NAME: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(2-fluorophenyl)ethanamide
MOLECULAR FORMULA: C22H27FN2O
MOLECULAR WEIGHT: 354.460983
SMILES: CN(CC1=CC=CC=C1NC(=O)CC2=CC=CC=C2F)C3CCCCC3
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Product OPENEYE NAME: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)acetyl]amino]phenyl]methyl]ammonium
CAS Name: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)-1-oxoethyl]amino]phenyl]methyl]ammonium
IUPAC NAME: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)acetyl]amino]phenyl]methyl]azanium
SYSTEMATIC NAME: cyclohexyl-methyl-[[2-[2-(2-nitrophenyl)ethanoylamino]phenyl]methyl]azanium
MOLECULAR FORMULA: C22H28N3O3+
MOLECULAR WEIGHT: 382.47602
SMILES: C[NH+](CC1=CC=CC=C1NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3CCCCC3
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