Sunday, October 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(2-thienylsulfanyl)propan-2-ol
CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-(thiophen-2-ylthio)-2-propanol
IUPAC NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-thiophen-2-ylsulfanylpropan-2-ol
SYSTEMATIC NAME: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-thiophen-2-ylsulfanyl-propan-2-ol
MOLECULAR FORMULA: C24H28N2OS2
MOLECULAR WEIGHT: 424.62192
SMILES: C1CN(CCN1CC(CSC2=CC=CS2)O)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-[3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]piperidine-4-carboxamide
CAS Name: 1-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C17H26N2O3
MOLECULAR WEIGHT: 306.39994
SMILES: CC1=C(C=C(C=C1)OCC(CN2CCC(CC2)C(=O)N)O)C
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Product OPENEYE NAME: 1-(3,4-dimethylphenoxy)-3-(indan-2-ylamino)propan-2-ol
CAS Name: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(3,4-dimethylphenoxy)-2-propanol
IUPAC NAME: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC1=C(C=C(C=C1)OCC(CNC2CC3=CC=CC=C3C2)O)C
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
CAS Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(3,4-dimethylphenoxy)-2-propanol
IUPAC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
MOLECULAR FORMULA: C19H23NO4
MOLECULAR WEIGHT: 329.39022
SMILES: CC1=C(C=C(C=C1)OCC(CNCC2=CC3=C(C=C2)OCO3)O)C
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-nitrophenoxy)propan-2-ol
CAS Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-nitrophenoxy)-2-propanol
IUPAC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-nitrophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-nitrophenoxy)propan-2-ol
MOLECULAR FORMULA: C17H18N2O6
MOLECULAR WEIGHT: 346.33462
SMILES: C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)[N+](=O)[O-])O
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Product OPENEYE NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-chlorophenoxy)propan-2-ol
CAS Name: 1-(4-chlorophenoxy)-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol
IUPAC NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-chlorophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(4-chloranylphenoxy)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol
MOLECULAR FORMULA: C26H29ClN2O2
MOLECULAR WEIGHT: 436.97366
SMILES: C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-(4-chlorophenoxy)-3-(indan-2-ylamino)propan-2-ol
CAS Name: 1-(4-chlorophenoxy)-3-(2,3-dihydro-1H-inden-2-ylamino)-2-propanol
IUPAC NAME: 1-(4-chlorophenoxy)-3-(2,3-dihydro-1H-inden-2-ylamino)propan-2-ol
SYSTEMATIC NAME: 1-(4-chloranylphenoxy)-3-(2,3-dihydro-1H-inden-2-ylamino)propan-2-ol
MOLECULAR FORMULA: C18H20ClNO2
MOLECULAR WEIGHT: 317.8099
SMILES: C1C(CC2=CC=CC=C21)NCC(COC3=CC=C(C=C3)Cl)O
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Product OPENEYE NAME: 1-[2-hydroxy-3-(4-methyl-2-nitro-phenoxy)propyl]piperidine-4-carboxamide
CAS Name: 1-[2-hydroxy-3-(4-methyl-2-nitrophenoxy)propyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[2-hydroxy-3-(4-methyl-2-nitrophenoxy)propyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[3-(4-methyl-2-nitro-phenoxy)-2-oxidanyl-propyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C16H23N3O5
MOLECULAR WEIGHT: 337.37092
SMILES: CC1=CC(=C(C=C1)OCC(CN2CCC(CC2)C(=O)N)O)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-[4-(trifluoromethylsulfanyl)phenoxy]propan-2-ol
CAS Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-[4-(trifluoromethylthio)phenoxy]-2-propanol
IUPAC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-[4-(trifluoromethylsulfanyl)phenoxy]propan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-[4-(trifluoromethylsulfanyl)phenoxy]propan-2-ol
MOLECULAR FORMULA: C18H18F3NO4S
MOLECULAR WEIGHT: 401.40003
SMILES: C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)SC(F)(F)F)O
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Product OPENEYE NAME: 2-(1,3-benzodioxol-5-ylmethylamino)-1-(3-nitrophenyl)ethanol
CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-1-(3-nitrophenyl)ethanol
IUPAC NAME: 2-(1,3-benzodioxol-5-ylmethylamino)-1-(3-nitrophenyl)ethanol
SYSTEMATIC NAME: 2-(1,3-benzodioxol-5-ylmethylamino)-1-(3-nitrophenyl)ethanol
MOLECULAR FORMULA: C16H16N2O5
MOLECULAR WEIGHT: 316.30864
SMILES: C1OC2=C(O1)C=C(C=C2)CNCC(C3=CC(=CC=C3)[N+](=O)[O-])O
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Product OPENEYE NAME: 1-[2-hydroxy-2-(3-nitrophenyl)ethyl]piperidine-4-carboxamide
CAS Name: 1-[2-hydroxy-2-(3-nitrophenyl)ethyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[2-hydroxy-2-(3-nitrophenyl)ethyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[2-(3-nitrophenyl)-2-oxidanyl-ethyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C14H19N3O4
MOLECULAR WEIGHT: 293.31836
SMILES: C1CN(CCC1C(=O)N)CC(C2=CC(=CC=C2)[N+](=O)[O-])O
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Product OPENEYE NAME: (4-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (4-fluorophenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (4-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (4-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H19FN4O3
MOLECULAR WEIGHT: 394.398963
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[4-(3-chloro-4-methyl-phenyl)-5-methyl-thiazol-2-yl]-4-methyl-benzamide
CAS Name: N-[4-(3-chloro-4-methylphenyl)-5-methyl-2-thiazolyl]-4-methylbenzamide
IUPAC NAME: N-[4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-yl]-4-methylbenzamide
SYSTEMATIC NAME: N-[4-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,3-thiazol-2-yl]-4-methyl-benzamide
MOLECULAR FORMULA: C19H17ClN2OS
MOLECULAR WEIGHT: 356.86908
SMILES: CC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)C)C3=CC(=C(C=C3)C)Cl
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Product OPENEYE NAME: N-[4-(3-chloro-4-methyl-phenyl)-5-methyl-thiazol-2-yl]thiophene-2-carboxamide
CAS Name: N-[4-(3-chloro-4-methylphenyl)-5-methyl-2-thiazolyl]-2-thiophenecarboxamide
IUPAC NAME: N-[4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[4-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
MOLECULAR FORMULA: C16H13ClN2OS2
MOLECULAR WEIGHT: 348.87022
SMILES: CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=CS3)C)Cl
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Product OPENEYE NAME: N-[4-(3-chloro-4-methyl-phenyl)-5-methyl-thiazol-2-yl]benzamide
CAS Name: N-[4-(3-chloro-4-methylphenyl)-5-methyl-2-thiazolyl]benzamide
IUPAC NAME: N-[4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-yl]benzamide
SYSTEMATIC NAME: N-[4-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,3-thiazol-2-yl]benzamide
MOLECULAR FORMULA: C18H15ClN2OS
MOLECULAR WEIGHT: 342.8425
SMILES: CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=CC=C3)C)Cl
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Product OPENEYE NAME: N-[4-(3-chloro-4-methyl-phenyl)-5-methyl-thiazol-2-yl]cyclopropanecarboxamide
CAS Name: N-[4-(3-chloro-4-methylphenyl)-5-methyl-2-thiazolyl]cyclopropanecarboxamide
IUPAC NAME: N-[4-(3-chloro-4-methylphenyl)-5-methyl-1,3-thiazol-2-yl]cyclopropanecarboxamide
SYSTEMATIC NAME: N-[4-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,3-thiazol-2-yl]cyclopropanecarboxamide
MOLECULAR FORMULA: C15H15ClN2OS
MOLECULAR WEIGHT: 306.8104
SMILES: CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3CC3)C)Cl
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Product OPENEYE NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanol
CAS Name: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-1-imidazolyl)ethanol
IUPAC NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitroimidazol-1-yl)ethanol
SYSTEMATIC NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanol
MOLECULAR FORMULA: C12H12FN3O3
MOLECULAR WEIGHT: 265.240383
SMILES: CC1=NC(=CN1CC(C2=CC=C(C=C2)F)O)[N+](=O)[O-]
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(p-tolyl)methanone
CAS Name: (4-methylphenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (4-methylphenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (4-methylphenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C22H22N4O3
MOLECULAR WEIGHT: 390.43508
SMILES: CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4
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Product OPENEYE NAME: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(4-phenylphenyl)ethanone
CAS Name: 2-(2-methyl-4-nitro-1-imidazolyl)-1-(4-phenylphenyl)ethanone
IUPAC NAME: 2-(2-methyl-4-nitroimidazol-1-yl)-1-(4-phenylphenyl)ethanone
SYSTEMATIC NAME: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(4-phenylphenyl)ethanone
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: CC1=NC(=CN1CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: (4-methoxyphenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (4-methoxyphenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (4-methoxyphenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (4-methoxyphenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C22H22N4O4
MOLECULAR WEIGHT: 406.43448
SMILES: COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4
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Product OPENEYE NAME: (2,6-dichlorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (2,6-dichlorophenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (2,6-dichlorophenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: [2,6-bis(chloranyl)phenyl]-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H18Cl2N4O3
MOLECULAR WEIGHT: 445.29862
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=C(C=CC=C4Cl)Cl
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(4-propylphenyl)methanone
CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-(4-propylphenyl)methanone
IUPAC NAME: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-(4-propylphenyl)methanone
SYSTEMATIC NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(4-propylphenyl)methanone
MOLECULAR FORMULA: C24H26N4O3
MOLECULAR WEIGHT: 418.48824
SMILES: CCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4
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Product OPENEYE NAME: (2,6-difluorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (2,6-difluorophenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (2,6-difluorophenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: [2,6-bis(fluoranyl)phenyl]-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H18F2N4O3
MOLECULAR WEIGHT: 412.389426
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=C(C=CC=C4F)F
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