Friday, March 30, 2012

All Chemical Compounds Information



Product OPENEYE NAME: (2S)-1-[2-(4-methoxyphenyl)indol-1-yl]-3-[[(2S)-tetrahydrofuran-2-yl]methylamino]propan-2-ol
CAS Name: (2S)-1-[2-(4-methoxyphenyl)-1-indolyl]-3-[[(2S)-2-oxolanyl]methylamino]-2-propanol
IUPAC NAME: (2S)-1-[2-(4-methoxyphenyl)indol-1-yl]-3-[[(2S)-oxolan-2-yl]methylamino]propan-2-ol
SYSTEMATIC NAME: (2S)-1-[2-(4-methoxyphenyl)indol-1-yl]-3-[[(2S)-oxolan-2-yl]methylamino]propan-2-ol
MOLECULAR FORMULA: C23H28N2O3
MOLECULAR WEIGHT: 380.48002
SMILES: COC1=CC=C(C=C1)C2=CC3=CC=CC=C3N2C[C@H](CNC[C@@H]4CCCO4)O
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Product OPENEYE NAME: (2R)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
CAS Name: (2R)-1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-[2-(4-methoxyphenyl)-1-indolyl]-2-propanol
IUPAC NAME: (2R)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
SYSTEMATIC NAME: (2R)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
MOLECULAR FORMULA: C24H31N3O3
MOLECULAR WEIGHT: 409.52124
SMILES: COC1=CC=C(C=C1)C2=CC3=CC=CC=C3N2C[C@@H](CN4CCN(CC4)CCO)O
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Product OPENEYE NAME: (2S)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
CAS Name: (2S)-1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-[2-(4-methoxyphenyl)-1-indolyl]-2-propanol
IUPAC NAME: (2S)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
SYSTEMATIC NAME: (2S)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[2-(4-methoxyphenyl)indol-1-yl]propan-2-ol
MOLECULAR FORMULA: C24H31N3O3
MOLECULAR WEIGHT: 409.52124
SMILES: COC1=CC=C(C=C1)C2=CC3=CC=CC=C3N2C[C@H](CN4CCN(CC4)CCO)O
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Product OPENEYE NAME: (2R)-1-(2-allyl-4-methyl-phenoxy)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propan-2-ol
CAS Name: (2R)-1-[2-(hydroxymethyl)-1-benzimidazolyl]-3-(4-methyl-2-prop-2-enylphenoxy)-2-propanol
IUPAC NAME: (2R)-1-[2-(hydroxymethyl)benzimidazol-1-yl]-3-(4-methyl-2-prop-2-enylphenoxy)propan-2-ol
SYSTEMATIC NAME: (2R)-1-[2-(hydroxymethyl)benzimidazol-1-yl]-3-(4-methyl-2-prop-2-enyl-phenoxy)propan-2-ol
MOLECULAR FORMULA: C21H24N2O3
MOLECULAR WEIGHT: 352.42686
SMILES: CC1=CC(=C(C=C1)OC[C@@H](CN2C3=CC=CC=C3N=C2CO)O)CC=C
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Product OPENEYE NAME: (2S)-1-(2-allyl-4-methyl-phenoxy)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propan-2-ol
CAS Name: (2S)-1-[2-(hydroxymethyl)-1-benzimidazolyl]-3-(4-methyl-2-prop-2-enylphenoxy)-2-propanol
IUPAC NAME: (2S)-1-[2-(hydroxymethyl)benzimidazol-1-yl]-3-(4-methyl-2-prop-2-enylphenoxy)propan-2-ol
SYSTEMATIC NAME: (2S)-1-[2-(hydroxymethyl)benzimidazol-1-yl]-3-(4-methyl-2-prop-2-enyl-phenoxy)propan-2-ol
MOLECULAR FORMULA: C21H24N2O3
MOLECULAR WEIGHT: 352.42686
SMILES: CC1=CC(=C(C=C1)OC[C@H](CN2C3=CC=CC=C3N=C2CO)O)CC=C
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Product OPENEYE NAME: 2-chloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
CAS Name: 2-chloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
MOLECULAR FORMULA: C10H5ClF3N3OS
MOLECULAR WEIGHT: 307.67941
SMILES: C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)C(F)(F)F)Cl
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Product OPENEYE NAME: 2,4-dichloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
CAS Name: 2,4-dichloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
IUPAC NAME: 2,4-dichloro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
MOLECULAR FORMULA: C10H4Cl2F3N3OS
MOLECULAR WEIGHT: 342.12447
SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)NC2=NN=C(S2)C(F)(F)F
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Product OPENEYE NAME: 2,6-dimethoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzamide
CAS Name: 2,6-dimethoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzamide
IUPAC NAME: 2,6-dimethoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzamide
SYSTEMATIC NAME: 2,6-dimethoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzamide
MOLECULAR FORMULA: C19H19N3O4S
MOLECULAR WEIGHT: 385.43686
SMILES: COC1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3=C(C=CC=C3OC)OC
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Product OPENEYE NAME: 4-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
CAS Name: 4-nitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide
IUPAC NAME: 4-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
SYSTEMATIC NAME: 4-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
MOLECULAR FORMULA: C16H17N3O6S2
MOLECULAR WEIGHT: 411.45268
SMILES: C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
CAS Name: 4-methoxy-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide
IUPAC NAME: 4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
SYSTEMATIC NAME: 4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide
MOLECULAR FORMULA: C17H20N2O5S2
MOLECULAR WEIGHT: 396.4811
SMILES: COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3
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Product OPENEYE NAME: 4-methoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide
CAS Name: 4-methoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide
IUPAC NAME: 4-methoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide
SYSTEMATIC NAME: 4-methoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide
MOLECULAR FORMULA: C17H17N3O4S2
MOLECULAR WEIGHT: 391.46458
SMILES: COC1=CC=C(C=C1)CC2=NN=C(S2)NS(=O)(=O)C3=CC=C(C=C3)OC
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