Friday, April 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-methoxy-5-methyl-phenyl)acetamide
CAS Name: N-(2-methoxy-5-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide
IUPAC NAME: N-(2-methoxy-5-methylphenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(2-methoxy-5-methyl-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H21N3O3S
MOLECULAR WEIGHT: 395.47474
SMILES: CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C
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Product OPENEYE NAME: 3-allyl-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one
CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-3-prop-2-enyl-4-quinazolinone
IUPAC NAME: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-prop-2-enylquinazolin-4-one
SYSTEMATIC NAME: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one
MOLECULAR FORMULA: C22H21N3O2S
MOLECULAR WEIGHT: 391.48604
SMILES: C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCCC4=CC=CC=C43
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C14H17N3OS
MOLECULAR WEIGHT: 275.36928
SMILES: C1C[C@@H](OC1)CNC2=C3C4=C(CCC4)SC3=NC=N2
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
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MOLECULAR FORMULA: C14H17N3OS
MOLECULAR WEIGHT: 275.36928
SMILES: C1C[C@H](OC1)CNC2=C3C4=C(CCC4)SC3=NC=N2
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Product OPENEYE NAME: 2-[4-[4-[[(2R)-tetrahydrofuran-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
CAS Name: 2-[4-[4-[[(2R)-2-oxolanyl]methylamino]-2-quinazolinyl]-1-piperazinyl]ethanol
IUPAC NAME: 2-[4-[4-[[(2R)-oxolan-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-[4-[[(2R)-oxolan-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C19H27N5O2
MOLECULAR WEIGHT: 357.44998
SMILES: C1C[C@@H](OC1)CNC2=NC(=NC3=CC=CC=C32)N4CCN(CC4)CCO
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Product OPENEYE NAME: 2-[4-[4-[[(2S)-tetrahydrofuran-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
CAS Name: 2-[4-[4-[[(2S)-2-oxolanyl]methylamino]-2-quinazolinyl]-1-piperazinyl]ethanol
IUPAC NAME: 2-[4-[4-[[(2S)-oxolan-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-[4-[[(2S)-oxolan-2-yl]methylamino]quinazolin-2-yl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C19H27N5O2
MOLECULAR WEIGHT: 357.44998
SMILES: C1C[C@H](OC1)CNC2=NC(=NC3=CC=CC=C32)N4CCN(CC4)CCO
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Product OPENEYE NAME: (2R)-2-(benzofuro[3,2-d]pyrimidin-4-ylamino)-3-(1H-indol-3-yl)propanoic acid
CAS Name: (2R)-2-(4-benzofuro[3,2-d]pyrimidinylamino)-3-(1H-indol-3-yl)propanoic acid
IUPAC NAME: (2R)-2-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)-3-(1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: (2R)-2-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)-3-(1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C21H16N4O3
MOLECULAR WEIGHT: 372.37674
SMILES: C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)NC3=NC=NC4=C3OC5=CC=CC=C54
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Product OPENEYE NAME: 4-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine
CAS Name: 4-[4-(1H-benzimidazol-2-ylmethyl)-1-piperazinyl]-6-ethylthieno[2,3-d]pyrimidine
IUPAC NAME: 4-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-6-ethylthieno[2,3-d]pyrimidine
SYSTEMATIC NAME: 4-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine
MOLECULAR FORMULA: C20H22N6S
MOLECULAR WEIGHT: 378.49388
SMILES: CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)CC4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine
CAS Name: 4-[4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]-6-ethylthieno[2,3-d]pyrimidine
IUPAC NAME: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-ethylthieno[2,3-d]pyrimidine
SYSTEMATIC NAME: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine
MOLECULAR FORMULA: C18H22N6S
MOLECULAR WEIGHT: 354.47248
SMILES: CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C4=NC(=CC(=N4)C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H22N4O2S
MOLECULAR WEIGHT: 394.48998
SMILES: C1CC2=C(C1)SC3=NC=NC(=C23)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6
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Product OPENEYE NAME: (4R)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CAS Name: (4R)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
IUPAC NAME: (4R)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SYSTEMATIC NAME: (4R)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
MOLECULAR FORMULA: C20H20FN3O4
MOLECULAR WEIGHT: 385.388903
SMILES: CC1=C([C@H](NC(=O)N1)C2=CC(=C(C=C2)OC)OC)C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: (4S)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CAS Name: (4S)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
IUPAC NAME: (4S)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SYSTEMATIC NAME: (4S)-4-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
MOLECULAR FORMULA: C20H20FN3O4
MOLECULAR WEIGHT: 385.388903
SMILES: CC1=C([C@@H](NC(=O)N1)C2=CC(=C(C=C2)OC)OC)C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: (4R)-N-(4-fluorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
CAS Name: (4R)-N-(4-fluorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
IUPAC NAME: (4R)-N-(4-fluorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
SYSTEMATIC NAME: (4R)-N-(4-fluorophenyl)-6-methyl-2-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
MOLECULAR FORMULA: C21H22FN3O5
MOLECULAR WEIGHT: 415.414883
SMILES: CC1=C([C@H](NC(=O)N1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)NC3=CC=C(C=C3)F
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