Saturday, October 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-(3,4-dichlorophenyl)-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one
CAS Name: 3-(3,4-dichlorophenyl)-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-quinazolinone
IUPAC NAME: 3-(3,4-dichlorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylquinazolin-4-one
SYSTEMATIC NAME: 3-(3,4-dichlorophenyl)-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one
MOLECULAR FORMULA: C22H13Cl2FN2O2S
MOLECULAR WEIGHT: 459.320223
SMILES: C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)Cl)Cl
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-fluorophenoxy)propan-2-ol
CAS Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-fluorophenoxy)-2-propanol
IUPAC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-fluorophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-fluoranylphenoxy)propan-2-ol
MOLECULAR FORMULA: C17H18FNO4
MOLECULAR WEIGHT: 319.327523
SMILES: C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)F)O
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Product OPENEYE NAME: 1-[3-(4-fluorophenoxy)-2-hydroxy-propyl]piperidine-4-carboxamide
CAS Name: 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C15H21FN2O3
MOLECULAR WEIGHT: 296.337243
SMILES: C1CN(CCC1C(=O)N)CC(COC2=CC=C(C=C2)F)O
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Product OPENEYE NAME: 4-[5-[(3,5-difluorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-aniline
CAS Name: 4-[5-[(3,5-difluorophenyl)methylthio]-1-tetrazolyl]-N,N-dimethylaniline
IUPAC NAME: 4-[5-[(3,5-difluorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[5-[[3,5-bis(fluoranyl)phenyl]methylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C16H15F2N5S
MOLECULAR WEIGHT: 347.385606
SMILES: CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC(=CC(=C3)F)F
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Product OPENEYE NAME: 4-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-aniline
CAS Name: 4-[5-[(2-chloro-6-fluorophenyl)methylthio]-1-tetrazolyl]-N,N-dimethylaniline
IUPAC NAME: 4-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C16H15ClFN5S
MOLECULAR WEIGHT: 363.840203
SMILES: CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=C(C=CC=C3Cl)F
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Product OPENEYE NAME: N,N-dimethyl-4-[5-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]tetrazol-1-yl]aniline
CAS Name: N,N-dimethyl-4-[5-[[4-(trifluoromethoxy)phenyl]methylthio]-1-tetrazolyl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]tetrazol-1-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]-1,2,3,4-tetrazol-1-yl]aniline
MOLECULAR FORMULA: C17H16F3N5OS
MOLECULAR WEIGHT: 395.40205
SMILES: CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 4-[5-[(4-chlorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-aniline
CAS Name: 4-[5-[(4-chlorophenyl)methylthio]-1-tetrazolyl]-N,N-dimethylaniline
IUPAC NAME: 4-[5-[(4-chlorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[5-[(4-chlorophenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C16H16ClN5S
MOLECULAR WEIGHT: 345.84974
SMILES: CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-aniline
CAS Name: 4-[5-[(3,4-dichlorophenyl)methylthio]-1-tetrazolyl]-N,N-dimethylaniline
IUPAC NAME: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C16H15Cl2N5S
MOLECULAR WEIGHT: 380.2948
SMILES: CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC(=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 1-[1-[4-(dimethylamino)phenyl]tetrazol-5-yl]sulfanyl-3,3-dimethyl-butan-2-one
CAS Name: 1-[[1-[4-(dimethylamino)phenyl]-5-tetrazolyl]thio]-3,3-dimethyl-2-butanone
IUPAC NAME: 1-[1-[4-(dimethylamino)phenyl]tetrazol-5-yl]sulfanyl-3,3-dimethylbutan-2-one
SYSTEMATIC NAME: 1-[[1-[4-(dimethylamino)phenyl]-1,2,3,4-tetrazol-5-yl]sulfanyl]-3,3-dimethyl-butan-2-one
MOLECULAR FORMULA: C15H21N5OS
MOLECULAR WEIGHT: 319.42514
SMILES: CC(C)(C)C(=O)CSC1=NN=NN1C2=CC=C(C=C2)N(C)C
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Product OPENEYE NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-fluorophenoxy)propan-2-ol
CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-(4-fluorophenoxy)-2-propanol
IUPAC NAME: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-fluorophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(4-fluoranylphenoxy)propan-2-ol
MOLECULAR FORMULA: C26H29FN2O2
MOLECULAR WEIGHT: 420.519063
SMILES: C1CN(CCN1CC(COC2=CC=C(C=C2)F)O)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-(4-fluorophenoxy)-3-(indan-2-ylamino)propan-2-ol
CAS Name: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(4-fluorophenoxy)-2-propanol
IUPAC NAME: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(4-fluorophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-2-ylamino)-3-(4-fluoranylphenoxy)propan-2-ol
MOLECULAR FORMULA: C18H20FNO2
MOLECULAR WEIGHT: 301.355303
SMILES: C1C(CC2=CC=CC=C21)NCC(COC3=CC=C(C=C3)F)O
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