Wednesday, October 31, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(3-ethoxy-4-hydroxy-phenyl)-2,3-dihydro-1H-quinazolin-4-one
CAS Name: 2-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
IUPAC NAME: 2-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-(3-ethoxy-4-oxidanyl-phenyl)-2,3-dihydro-1H-quinazolin-4-one
MOLECULAR FORMULA: C16H16N2O3
MOLECULAR WEIGHT: 284.30984
SMILES: CCOC1=C(C=CC(=C1)C2NC3=CC=CC=C3C(=O)N2)O
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Product OPENEYE NAME: 2-(3-phenoxyphenyl)-1H-quinazolin-4-one
CAS Name: 2-(3-phenoxyphenyl)-1H-quinazolin-4-one
IUPAC NAME: 2-(3-phenoxyphenyl)-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-(3-phenoxyphenyl)-1H-quinazolin-4-one
MOLECULAR FORMULA: C20H14N2O2
MOLECULAR WEIGHT: 314.33736
SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=NC(=O)C4=CC=CC=C4N3
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Product OPENEYE NAME: ethyl 2-[(2-chloro-5-methoxy-phenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
CAS Name: 2-[[(2-chloro-5-methoxyanilino)-oxomethyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[(2-chloro-5-methoxyphenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[(2-chloranyl-5-methoxy-phenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C19H22ClN3O4S
MOLECULAR WEIGHT: 423.91368
SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)NC3=C(C=CC(=C3)OC)Cl
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Product OPENEYE NAME: ethyl 6-methyl-2-(p-tolylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
CAS Name: 6-methyl-2-[[(4-methylanilino)-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-methyl-2-[(4-methylphenyl)carbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 6-methyl-2-[(4-methylphenyl)carbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C19H23N3O3S
MOLECULAR WEIGHT: 373.46922
SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)NC3=CC=C(C=C3)C
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Product OPENEYE NAME: ethyl 2-(tert-butylcarbamoylamino)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
CAS Name: 2-[[(tert-butylamino)-oxomethyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-(tert-butylcarbamoylamino)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-(tert-butylcarbamoylamino)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C16H25N3O3S
MOLECULAR WEIGHT: 339.453
SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)NC(C)(C)C
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Product OPENEYE NAME: ethyl 6-methyl-2-(p-tolylsulfonylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
CAS Name: 6-methyl-2-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-methyl-2-[(4-methylphenyl)sulfonylcarbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 6-methyl-2-[(4-methylphenyl)sulfonylcarbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C19H23N3O5S2
MOLECULAR WEIGHT: 437.53302
SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: ethyl 2-[(4-fluorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
CAS Name: 2-[[(4-fluoroanilino)-oxomethyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[(4-fluorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[(4-fluorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C18H20FN3O3S
MOLECULAR WEIGHT: 377.433103
SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[2-[(3-chloro-2-fluoro-phenyl)methylsulfanyl]phenyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide
CAS Name: N-[2-[(3-chloro-2-fluorophenyl)methylthio]phenyl]-5-methyl-1-phenyl-4-pyrazolecarboxamide
IUPAC NAME: N-[2-[(3-chloro-2-fluorophenyl)methylsulfanyl]phenyl]-5-methyl-1-phenylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-[2-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfanyl]phenyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C24H19ClFN3OS
MOLECULAR WEIGHT: 451.943563
SMILES: CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC=CC=C3SCC4=C(C(=CC=C4)Cl)F
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Product OPENEYE NAME: [4-(2-methoxyphenyl)-1-piperidyl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone
CAS Name: [4-(2-methoxyphenyl)-1-piperidinyl]-(5-methyl-1-phenyl-4-pyrazolyl)methanone
IUPAC NAME: [4-(2-methoxyphenyl)piperidin-1-yl]-(5-methyl-1-phenylpyrazol-4-yl)methanone
SYSTEMATIC NAME: [4-(2-methoxyphenyl)piperidin-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone
MOLECULAR FORMULA: C23H25N3O2
MOLECULAR WEIGHT: 375.4635
SMILES: CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)C4=CC=CC=C4OC
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Product OPENEYE NAME: ethyl 1-(3-chloro-4-fluoro-phenyl)-5-(thiophene-2-carbonylamino)triazole-4-carboxylate
CAS Name: 1-(3-chloro-4-fluorophenyl)-5-[[oxo(thiophen-2-yl)methyl]amino]-4-triazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(3-chloro-4-fluorophenyl)-5-(thiophene-2-carbonylamino)triazole-4-carboxylate
SYSTEMATIC NAME: ethyl 1-(3-chloranyl-4-fluoranyl-phenyl)-5-(thiophen-2-ylcarbonylamino)-1,2,3-triazole-4-carboxylate
MOLECULAR FORMULA: C16H12ClFN4O3S
MOLECULAR WEIGHT: 394.807883
SMILES: CCOC(=O)C1=C(N(N=N1)C2=CC(=C(C=C2)F)Cl)NC(=O)C3=CC=CS3
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Product OPENEYE NAME: 3,5-diphenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CAS Name: 3,5-diphenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
IUPAC NAME: 3,5-diphenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SYSTEMATIC NAME: 3,5-diphenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
MOLECULAR FORMULA: C19H12F3N3O
MOLECULAR WEIGHT: 355.31329
SMILES: C1=CC=C(C=C1)C2=CC(=O)N3C(=N2)C(=C(N3)C(F)(F)F)C4=CC=CC=C4
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Product OPENEYE NAME: 5-tert-butyl-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CAS Name: 5-tert-butyl-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
IUPAC NAME: 5-tert-butyl-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SYSTEMATIC NAME: 5-tert-butyl-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
MOLECULAR FORMULA: C17H16F3N3O
MOLECULAR WEIGHT: 335.32365
SMILES: CC(C)(C)C1=CC(=O)N2C(=N1)C(=C(N2)C(F)(F)F)C3=CC=CC=C3
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Product OPENEYE NAME: 3-phenyl-5-propyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CAS Name: 3-phenyl-5-propyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
IUPAC NAME: 3-phenyl-5-propyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SYSTEMATIC NAME: 3-phenyl-5-propyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
MOLECULAR FORMULA: C16H14F3N3O
MOLECULAR WEIGHT: 321.29707
SMILES: CCCC1=CC(=O)N2C(=N1)C(=C(N2)C(F)(F)F)C3=CC=CC=C3
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