Wednesday, January 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-(3,4-difluorophenyl)-4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazine-1-carboxamide
CAS Name: N-(3,4-difluorophenyl)-4-(6-methyl-2-phenyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinecarboxamide
IUPAC NAME: N-(3,4-difluorophenyl)-4-(6-methyl-2-phenyl-5-propan-2-ylpyrimidin-4-yl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-[3,4-bis(fluoranyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide
MOLECULAR FORMULA: C25H27F2N5O
MOLECULAR WEIGHT: 451.511586
SMILES: CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)NC4=CC(=C(C=C4)F)F)C(C)C
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Product OPENEYE NAME: N-isopropyl-4-methyl-N-[2-oxo-2-[[4-[2-oxo-2-[(2-oxoazepan-3-yl)amino]ethyl]thiazol-2-yl]amino]ethyl]benzamide
CAS Name: 4-methyl-N-[2-oxo-2-[[4-[2-oxo-2-[(2-oxo-3-azepanyl)amino]ethyl]-2-thiazolyl]amino]ethyl]-N-propan-2-ylbenzamide
IUPAC NAME: 4-methyl-N-[2-oxo-2-[[4-[2-oxo-2-[(2-oxoazepan-3-yl)amino]ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propan-2-ylbenzamide
SYSTEMATIC NAME: 4-methyl-N-[2-oxidanylidene-2-[[4-[2-oxidanylidene-2-[(2-oxidanylideneazepan-3-yl)amino]ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propan-2-yl-benzamide
MOLECULAR FORMULA: C24H31N5O4S
MOLECULAR WEIGHT: 485.59904
SMILES: CC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=NC(=CS2)CC(=O)NC3CCCCNC3=O)C(C)C
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Product OPENEYE NAME: N-butyl-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]thiazole-4-carboxamide
CAS Name: N-butyl-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-4-thiazolecarboxamide
IUPAC NAME: N-butyl-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxamide
SYSTEMATIC NAME: N-butyl-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxamide
MOLECULAR FORMULA: C28H37N3O5S
MOLECULAR WEIGHT: 527.67548
SMILES: CCCCNC(=O)C1=CSC(=N1)CN(CCC2=CC(=C(C=C2)OC)OC)CC3=C(C=C(C=C3)OC)OC
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(2-chloro-6-fluoro-phenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C23H17ClFNO4S
MOLECULAR WEIGHT: 457.901783
SMILES: COC1=CC=CC(=C1OCC2=C(C=CC=C2Cl)F)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C23H18FNO4S
MOLECULAR WEIGHT: 423.456723
SMILES: COC1=CC=CC(=C1OCC2=CC=CC=C2F)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C23H18ClNO4S
MOLECULAR WEIGHT: 439.91132
SMILES: COC1=CC=CC(=C1OCC2=CC(=CC=C2)Cl)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(3,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(3,4-dichlorophenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(3,4-dichlorophenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(3,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C23H17Cl2NO4S
MOLECULAR WEIGHT: 474.35638
SMILES: COC1=CC=CC(=C1OCC2=CC(=C(C=C2)Cl)Cl)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-(m-tolylmethoxy)phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[3-methoxy-2-[(3-methylphenyl)methoxy]phenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-[(3-methylphenyl)methoxy]phenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[3-methoxy-2-[(3-methylphenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C24H21NO4S
MOLECULAR WEIGHT: 419.49284
SMILES: CC1=CC(=CC=C1)COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(3,5-dimethylphenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(3,5-dimethylphenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(3,5-dimethylphenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(3,5-dimethylphenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C25H23NO4S
MOLECULAR WEIGHT: 433.51942
SMILES: CC1=CC(=CC(=C1)COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)C
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-(o-tolylmethoxy)phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[3-methoxy-2-[(2-methylphenyl)methoxy]phenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-[(2-methylphenyl)methoxy]phenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[3-methoxy-2-[(2-methylphenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C24H21NO4S
MOLECULAR WEIGHT: 419.49284
SMILES: CC1=CC=CC=C1COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[2-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[2-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[2-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[2-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C27H27NO4S
MOLECULAR WEIGHT: 461.57258
SMILES: CC(C)(C)C1=CC=C(C=C1)COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-(2-phenylethoxy)phenyl]prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-[3-methoxy-2-(2-phenylethoxy)phenyl]-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-[3-methoxy-2-(2-phenylethoxy)phenyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[3-methoxy-2-(2-phenylethoxy)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C24H21NO4S
MOLECULAR WEIGHT: 419.49284
SMILES: COC1=CC=CC(=C1OCCC2=CC=CC=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(3-methoxy-2-propoxy-phenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(3-methoxy-2-propoxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(3-methoxy-2-propoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(3-methoxy-2-propoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C19H19NO4S
MOLECULAR WEIGHT: 357.42346
SMILES: CCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(2-ethoxy-3-methoxy-phenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(2-ethoxy-3-methoxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(2-ethoxy-3-methoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(2-ethoxy-3-methoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C18H17NO4S
MOLECULAR WEIGHT: 343.39688
SMILES: CCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(3-methoxy-2-pentoxy-phenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(3-methoxy-2-pentoxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(3-methoxy-2-pentoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(3-methoxy-2-pentoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C21H23NO4S
MOLECULAR WEIGHT: 385.47662
SMILES: CCCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(2-hexoxy-3-methoxy-phenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(2-hexoxy-3-methoxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(2-hexoxy-3-methoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(2-hexoxy-3-methoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C22H25NO4S
MOLECULAR WEIGHT: 399.5032
SMILES: CCCCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(2-isopropoxy-3-methoxy-phenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(3-methoxy-2-propan-2-yloxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(3-methoxy-2-propan-2-yloxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(3-methoxy-2-propan-2-yloxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C19H19NO4S
MOLECULAR WEIGHT: 357.42346
SMILES: CC(C)OC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(benzenesulfonyl)-3-(3-ethoxyphenyl)prop-2-enenitrile
CAS Name: 2-(benzenesulfonyl)-3-(3-ethoxyphenyl)-2-propenenitrile
IUPAC NAME: 2-(benzenesulfonyl)-3-(3-ethoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(3-ethoxyphenyl)-2-(phenylsulfonyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H15NO3S
MOLECULAR WEIGHT: 313.3709
SMILES: CCOC1=CC=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2,3,4,5,6-pentafluoro-N-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methylimidazol-2-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]benzamide
CAS Name: 2,3,4,5,6-pentafluoro-N-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[(1-methyl-2-imidazolyl)thio]methyl]-1,3-dioxan-2-yl]phenyl]benzamide
IUPAC NAME: 2,3,4,5,6-pentafluoro-N-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methylimidazol-2-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]benzamide
SYSTEMATIC NAME: 2,3,4,5,6-pentakis(fluoranyl)-N-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methylimidazol-2-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]benzamide
MOLECULAR FORMULA: C29H24F5N3O4S
MOLECULAR WEIGHT: 605.575576
SMILES: CN1C=CN=C1SCC2CC(OC(O2)C3=CC(=CC=C3)NC(=O)C4=C(C(=C(C(=C4F)F)F)F)F)C5=CC=C(C=C5)CO
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Product OPENEYE NAME: ethyl 2-[[3-[4-[4-[[benzyl(methyl)amino]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylcarbamoylamino]acetate
CAS Name: 2-[[[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-(phenylmethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-oxomethyl]amino]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[[3-[4-[4-[[benzyl(methyl)amino]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylcarbamoylamino]acetate
SYSTEMATIC NAME: ethyl 2-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-(phenylmethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylcarbamoylamino]ethanoate
MOLECULAR FORMULA: C38H43N3O6
MOLECULAR WEIGHT: 637.76452
SMILES: CCOC(=O)CNC(=O)NCC1=CC=CC(=C1)C2=CC=C(C=C2)C3OC(CC(O3)C4=CC=C(C=C4)CO)CN(C)CC5=CC=CC=C5
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Product OPENEYE NAME: 1-benzyl-3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]urea
CAS Name: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-[2-(2-pyridinyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]urea
SYSTEMATIC NAME: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]-3-(phenylmethyl)urea
MOLECULAR FORMULA: C34H38N4O4
MOLECULAR WEIGHT: 566.68992
SMILES: CN(CCC1=CC=CC=N1)CC2CC(OC(O2)C3=CC(=CC=C3)NC(=O)NCC4=CC=CC=C4)C5=CC=C(C=C5)CO
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