Wednesday, May 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(2-quinolyl)-3-[[(2S)-tetrahydrofuran-2-yl]methoxy]benzamide
CAS Name: 3-[[(2S)-2-oxolanyl]methoxy]-N-(2-quinolinyl)benzamide
IUPAC NAME: 3-[[(2S)-oxolan-2-yl]methoxy]-N-quinolin-2-ylbenzamide
SYSTEMATIC NAME: 3-[[(2S)-oxolan-2-yl]methoxy]-N-quinolin-2-yl-benzamide
MOLECULAR FORMULA: C21H20N2O3
MOLECULAR WEIGHT: 348.3951
SMILES: C1C[C@H](OC1)COC2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4C=C3
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Product OPENEYE NAME: N-(2-quinolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methoxy]benzamide
CAS Name: 3-[[(2R)-2-oxolanyl]methoxy]-N-(2-quinolinyl)benzamide
IUPAC NAME: 3-[[(2R)-oxolan-2-yl]methoxy]-N-quinolin-2-ylbenzamide
SYSTEMATIC NAME: 3-[[(2R)-oxolan-2-yl]methoxy]-N-quinolin-2-yl-benzamide
MOLECULAR FORMULA: C21H20N2O3
MOLECULAR WEIGHT: 348.3951
SMILES: C1C[C@@H](OC1)COC2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4C=C3
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Product OPENEYE NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2S)-tetrahydrofuran-2-yl]methoxy]benzoate
CAS Name: 3-[[(2S)-2-oxolanyl]methoxy]benzoic acid (3-methyl-2-quinoxalinyl)methyl ester
IUPAC NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
SYSTEMATIC NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
MOLECULAR FORMULA: C22H22N2O4
MOLECULAR WEIGHT: 378.42108
SMILES: CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC(=CC=C3)OC[C@@H]4CCCO4
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Product OPENEYE NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2R)-tetrahydrofuran-2-yl]methoxy]benzoate
CAS Name: 3-[[(2R)-2-oxolanyl]methoxy]benzoic acid (3-methyl-2-quinoxalinyl)methyl ester
IUPAC NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2R)-oxolan-2-yl]methoxy]benzoate
SYSTEMATIC NAME: (3-methylquinoxalin-2-yl)methyl 3-[[(2R)-oxolan-2-yl]methoxy]benzoate
MOLECULAR FORMULA: C22H22N2O4
MOLECULAR WEIGHT: 378.42108
SMILES: CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC(=CC=C3)OC[C@H]4CCCO4
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Product OPENEYE NAME: (2S)-4-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CAS Name: (2S)-4-[(2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
IUPAC NAME: (2S)-4-(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
SYSTEMATIC NAME: (2S)-4-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonyl-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
MOLECULAR FORMULA: C22H24N4O3S
MOLECULAR WEIGHT: 424.51596
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3C[C@H](OC4=CC=CC=C43)C(=O)N(C)C)C)C
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Product OPENEYE NAME: (2R)-4-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CAS Name: (2R)-4-[(2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
IUPAC NAME: (2R)-4-(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
SYSTEMATIC NAME: (2R)-4-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonyl-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
MOLECULAR FORMULA: C22H24N4O3S
MOLECULAR WEIGHT: 424.51596
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3C[C@@H](OC4=CC=CC=C43)C(=O)N(C)C)C)C
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Product OPENEYE NAME: 2-ethyl-4,5-dimethyl-N-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]thieno[2,3-d]pyrimidine-6-carboxamide
CAS Name: 2-ethyl-4,5-dimethyl-N-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]-6-thieno[2,3-d]pyrimidinecarboxamide
IUPAC NAME: 2-ethyl-4,5-dimethyl-N-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]thieno[2,3-d]pyrimidine-6-carboxamide
SYSTEMATIC NAME: 2-ethyl-4,5-dimethyl-N-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]thieno[2,3-d]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C19H17F3N6OS
MOLECULAR WEIGHT: 434.43809
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCC3=NN=C4N3C=C(C=C4)C(F)(F)F)C)C
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Product OPENEYE NAME: (5-phenylisoxazol-3-yl)methyl 3-[[(2S)-tetrahydrofuran-2-yl]methoxy]benzoate
CAS Name: 3-[[(2S)-2-oxolanyl]methoxy]benzoic acid (5-phenyl-3-isoxazolyl)methyl ester
IUPAC NAME: (5-phenyl-1,2-oxazol-3-yl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
SYSTEMATIC NAME: (5-phenyl-1,2-oxazol-3-yl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
MOLECULAR FORMULA: C22H21NO5
MOLECULAR WEIGHT: 379.40584
SMILES: C1C[C@H](OC1)COC2=CC=CC(=C2)C(=O)OCC3=NOC(=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (5-phenylisoxazol-3-yl)methyl 3-[[(2R)-tetrahydrofuran-2-yl]methoxy]benzoate
CAS Name: 3-[[(2R)-2-oxolanyl]methoxy]benzoic acid (5-phenyl-3-isoxazolyl)methyl ester
IUPAC NAME: (5-phenyl-1,2-oxazol-3-yl)methyl 3-[[(2R)-oxolan-2-yl]methoxy]benzoate
SYSTEMATIC NAME: (5-phenyl-1,2-oxazol-3-yl)methyl 3-[[(2R)-oxolan-2-yl]methoxy]benzoate
MOLECULAR FORMULA: C22H21NO5
MOLECULAR WEIGHT: 379.40584
SMILES: C1C[C@@H](OC1)COC2=CC=CC(=C2)C(=O)OCC3=NOC(=C3)C4=CC=CC=C4
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Product OPENEYE NAME: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxamide
CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-1-(2-fluorophenyl)-5-methyl-4-pyrazolecarboxamide
IUPAC NAME: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-1-(2-fluorophenyl)-5-methylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C24H29FN5O+
MOLECULAR WEIGHT: 422.518363
SMILES: CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4F)C)C
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Product OPENEYE NAME: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxamide
CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-1-(2-fluorophenyl)-5-methyl-4-pyrazolecarboxamide
IUPAC NAME: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-1-(2-fluorophenyl)-5-methylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C24H28FN5O
MOLECULAR WEIGHT: 421.510423
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4F)C)C
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Product OPENEYE NAME: (4-cyano-2-fluoro-phenyl)methyl 3-[[(2S)-tetrahydrofuran-2-yl]methoxy]benzoate
CAS Name: 3-[[(2S)-2-oxolanyl]methoxy]benzoic acid (4-cyano-2-fluorophenyl)methyl ester
IUPAC NAME: (4-cyano-2-fluorophenyl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
SYSTEMATIC NAME: (4-cyano-2-fluoranyl-phenyl)methyl 3-[[(2S)-oxolan-2-yl]methoxy]benzoate
MOLECULAR FORMULA: C20H18FNO4
MOLECULAR WEIGHT: 355.359623
SMILES: C1C[C@H](OC1)COC2=CC=CC(=C2)C(=O)OCC3=C(C=C(C=C3)C#N)F
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