Thursday, January 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-yl)amino]benzamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-yl)amino]benzamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl)amino]benzamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-[[5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl]amino]-4-chloranyl-benzamide
MOLECULAR FORMULA: C20H18ClN3O5S2
MOLECULAR WEIGHT: 479.95702
SMILES: C1C2C(CS1(=O)=O)SC(=N2)NC3=C(C=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)Cl
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Product OPENEYE NAME: 2-[2-(benzylamino)-6-methyl-pyrimidin-4-yl]oxy-N-[(2-methoxyphenyl)methyleneamino]acetamide
CAS Name: N-[(2-methoxyphenyl)methylideneamino]-2-[[6-methyl-2-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]acetamide
IUPAC NAME: 2-[2-(benzylamino)-6-methylpyrimidin-4-yl]oxy-N-[(2-methoxyphenyl)methylideneamino]acetamide
SYSTEMATIC NAME: N-[(2-methoxyphenyl)methylideneamino]-2-[6-methyl-2-[(phenylmethyl)amino]pyrimidin-4-yl]oxy-ethanamide
MOLECULAR FORMULA: C22H23N5O3
MOLECULAR WEIGHT: 405.44972
SMILES: CC1=CC(=NC(=N1)NCC2=CC=CC=C2)OCC(=O)NN=CC3=CC=CC=C3OC
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H31ClFN5O6
MOLECULAR WEIGHT: 708.134043
SMILES: C1C=C2C(CC3C(=O)N(C(=O)C3(C2C4=CC=CC=C4OCCO)C5=CC=C(C=C5)Cl)NC6=CC=C(C=C6)F)N7N1C(=O)N(C7=O)C8=CC=CC=C8
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Product OPENEYE NAME: 2-(benzofuran-2-yl)-N-[[2-(benzofuran-2-yl)-7-methoxy-chromen-4-ylidene]amino]-7-methoxy-chromen-4-imine
CAS Name: 2-(2-benzofuranyl)-N-[[2-(2-benzofuranyl)-7-methoxy-1-benzopyran-4-ylidene]amino]-7-methoxy-1-benzopyran-4-imine
IUPAC NAME: 2-(1-benzofuran-2-yl)-N-[[2-(1-benzofuran-2-yl)-7-methoxychromen-4-ylidene]amino]-7-methoxychromen-4-imine
SYSTEMATIC NAME: 2-(1-benzofuran-2-yl)-N-[[2-(1-benzofuran-2-yl)-7-methoxy-chromen-4-ylidene]amino]-7-methoxy-chromen-4-imine
MOLECULAR FORMULA: C36H24N2O6
MOLECULAR WEIGHT: 580.58556
SMILES: COC1=CC2=C(C=C1)C(=NN=C3C=C(OC4=C3C=CC(=C4)OC)C5=CC6=CC=CC=C6O5)C=C(O2)C7=CC8=CC=CC=C8O7
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Product OPENEYE NAME: methyl 3-[(2-phenoxyacetyl)amino]-3-phenyl-propanoate
CAS Name: 3-[(1-oxo-2-phenoxyethyl)amino]-3-phenylpropanoic acid methyl ester
IUPAC NAME: methyl 3-[(2-phenoxyacetyl)amino]-3-phenylpropanoate
SYSTEMATIC NAME: methyl 3-(2-phenoxyethanoylamino)-3-phenyl-propanoate
MOLECULAR FORMULA: C18H19NO4
MOLECULAR WEIGHT: 313.34776
SMILES: COC(=O)CC(C1=CC=CC=C1)NC(=O)COC2=CC=CC=C2
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Product OPENEYE NAME: 4-(4-methoxyphenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinazoline-2,5-dione
CAS Name: 4-(4-methoxyphenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinazoline-2,5-dione
IUPAC NAME: 4-(4-methoxyphenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinazoline-2,5-dione
SYSTEMATIC NAME: 4-(4-methoxyphenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinazoline-2,5-dione
MOLECULAR FORMULA: C17H20N2O3
MOLECULAR WEIGHT: 300.3523
SMILES: CC1(CC2=C(C(NC(=O)N2)C3=CC=C(C=C3)OC)C(=O)C1)C
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Product OPENEYE NAME: 1-[1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-3,5-dimethyl-pyrazole
CAS Name: 1-[1-(2,4-dimethoxyphenyl)-2-nitroethyl]-3,5-dimethylpyrazole
IUPAC NAME: 1-[1-(2,4-dimethoxyphenyl)-2-nitroethyl]-3,5-dimethylpyrazole
SYSTEMATIC NAME: 1-[1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-3,5-dimethyl-pyrazole
MOLECULAR FORMULA: C15H19N3O4
MOLECULAR WEIGHT: 305.32906
SMILES: CC1=CC(=NN1C(C[N+](=O)[O-])C2=C(C=C(C=C2)OC)OC)C
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Product OPENEYE NAME: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-(4-methoxyphenyl)-N-(p-tolyl)prop-2-enamide
CAS Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-(4-methoxyphenyl)-N-(4-methylphenyl)-2-propenamide
IUPAC NAME: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-(4-methoxyphenyl)-N-(4-methylphenyl)prop-2-enamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-3-(4-methoxyphenyl)-N-(4-methylphenyl)prop-2-enamide
MOLECULAR FORMULA: C21H21NO4S
MOLECULAR WEIGHT: 383.46074
SMILES: CC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C=CC3=CC=C(C=C3)OC
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Product OPENEYE NAME: 2-[(4-chlorophenyl)-phenylsulfanyl-methyl]tetralin-1-one
CAS Name: 2-[(4-chlorophenyl)-(phenylthio)methyl]-3,4-dihydro-2H-naphthalen-1-one
IUPAC NAME: 2-[(4-chlorophenyl)-phenylsulfanylmethyl]-3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 2-[(4-chlorophenyl)-phenylsulfanyl-methyl]-3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C23H19ClOS
MOLECULAR WEIGHT: 378.91436
SMILES: C1CC2=CC=CC=C2C(=O)C1C(C3=CC=C(C=C3)Cl)SC4=CC=CC=C4
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Product OPENEYE NAME: (3-chlorophenyl)-(5,6-diethoxy-2-methylsulfanyl-benzimidazol-1-yl)methanone
CAS Name: (3-chlorophenyl)-[5,6-diethoxy-2-(methylthio)-1-benzimidazolyl]methanone
IUPAC NAME: (3-chlorophenyl)-(5,6-diethoxy-2-methylsulfanylbenzimidazol-1-yl)methanone
SYSTEMATIC NAME: (3-chlorophenyl)-(5,6-diethoxy-2-methylsulfanyl-benzimidazol-1-yl)methanone
MOLECULAR FORMULA: C19H19ClN2O3S
MOLECULAR WEIGHT: 390.88376
SMILES: CCOC1=C(C=C2C(=C1)N=C(N2C(=O)C3=CC(=CC=C3)Cl)SC)OCC
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Product OPENEYE NAME: N-(3-chlorophenyl)-2-(3,5-dichloro-4-hydroxy-phenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
CAS Name: N-(3-chlorophenyl)-2-(3,5-dichloro-4-hydroxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
IUPAC NAME: N-(3-chlorophenyl)-2-(3,5-dichloro-4-hydroxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
SYSTEMATIC NAME: 2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]imino-N-(3-chlorophenyl)-3-methyl-4-oxidanylidene-1,3-thiazinane-6-carboxamide
MOLECULAR FORMULA: C18H14Cl3N3O3S
MOLECULAR WEIGHT: 458.74606
SMILES: CN1C(=O)CC(SC1=NC2=CC(=C(C(=C2)Cl)O)Cl)C(=O)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: N-(4-ethylphenyl)-2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-acetamide
CAS Name: N-(4-ethylphenyl)-2-[[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(4-ethylphenyl)-2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(4-ethylphenyl)-2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C24H22FN5O3S
MOLECULAR WEIGHT: 479.526583
SMILES: CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[[5-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxy-benzamide
CAS Name: N-[[5-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide
IUPAC NAME: N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide
SYSTEMATIC NAME: N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxy-benzamide
MOLECULAR FORMULA: C29H26F3N5O4S
MOLECULAR WEIGHT: 597.60805
SMILES: COC1=C(C=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)N4CCC5=CC=CC=C54)OC
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H11IN2OS2
MOLECULAR WEIGHT: 378.25231
SMILES: CC1=C(SC2=C1C(=O)N3CC(SC3=N2)CI)C
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Product OPENEYE NAME: N-[4-hydroxy-3-(2-hydroxy-1-naphthyl)-1-naphthyl]benzenesulfonamide
CAS Name: N-[4-hydroxy-3-(2-hydroxy-1-naphthalenyl)-1-naphthalenyl]benzenesulfonamide
IUPAC NAME: N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)naphthalen-1-yl]benzenesulfonamide
SYSTEMATIC NAME: N-[4-oxidanyl-3-(2-oxidanylnaphthalen-1-yl)naphthalen-1-yl]benzenesulfonamide
MOLECULAR FORMULA: C26H19NO4S
MOLECULAR WEIGHT: 441.49836
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)C4=C(C=CC5=CC=CC=C54)O
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Product OPENEYE NAME: 1,6-bis[4-(2-ethoxyphenyl)piperazin-1-yl]-2,2,3,3,4,4,5,5-octafluoro-hexane-1,6-dione
CAS Name: 1,6-bis[4-(2-ethoxyphenyl)-1-piperazinyl]-2,2,3,3,4,4,5,5-octafluorohexane-1,6-dione
IUPAC NAME: 1,6-bis[4-(2-ethoxyphenyl)piperazin-1-yl]-2,2,3,3,4,4,5,5-octafluorohexane-1,6-dione
SYSTEMATIC NAME: 1,6-bis[4-(2-ethoxyphenyl)piperazin-1-yl]-2,2,3,3,4,4,5,5-octakis(fluoranyl)hexane-1,6-dione
MOLECULAR FORMULA: C30H34F8N4O4
MOLECULAR WEIGHT: 666.602586
SMILES: CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C(C(C(C(C(=O)N3CCN(CC3)C4=CC=CC=C4OCC)(F)F)(F)F)(F)F)(F)F
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Product OPENEYE NAME: 3-chloro-N-[2-[4-(3-chlorobenzothiophene-2-carbonyl)piperazin-1-yl]ethyl]benzothiophene-2-carboxamide
CAS Name: 3-chloro-N-[2-[4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]ethyl]-1-benzothiophene-2-carboxamide
IUPAC NAME: 3-chloro-N-[2-[4-(3-chloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]ethyl]-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: 3-chloranyl-N-[2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]ethyl]-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C24H21Cl2N3O2S2
MOLECULAR WEIGHT: 518.47844
SMILES: C1CN(CCN1CCNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)C4=C(C5=CC=CC=C5S4)Cl
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