Monday, October 10, 2011

http://ChemLookup.com Compounds




CAS RN: 154874-66-5
CAS Name: 1-[(1Z)-1-phenylmethoxyiminoethyl]-1-cyclohexanol
OPENEYE Name: 1-[(Z)-N-benzyloxy-C-methyl-carbonimidoyl]cyclohexanol
IUPAC Name: 1-[(Z)-C-methyl-N-phenylmethoxycarbonimidoyl]cyclohexan-1-ol
SYSTEMATIC NAME: 1-[(Z)-C-methyl-N-phenylmethoxy-carbonimidoyl]cyclohexan-1-ol
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: C/C(=N/OCC1=CC=CC=C1)/C2(CCCCC2)O
Structure:

CAS RN: 152449-63-3
CAS Name: N'-[5-(anilinomethyl)-2-imino-4-oxo-3-thiazolidinyl]-N-(4-methoxyphenyl)iminobenzenecarboximidamide
OPENEYE Name: N'-[5-(anilinomethyl)-2-imino-4-oxo-thiazolidin-3-yl]-N-(4-methoxyphenyl)imino-benzamidine
IUPAC Name: N'-[5-(anilinomethyl)-2-imino-4-oxo-1,3-thiazolidin-3-yl]-N-(4-methoxyphenyl)iminobenzenecarboximidamide
SYSTEMATIC NAME: N'-[2-azanylidene-4-oxidanylidene-5-(phenylazanylmethyl)-1,3-thiazolidin-3-yl]-N-(4-methoxyphenyl)imino-benzenecarboximidamide
MOLECULAR FORMULA: C24H22N6O2S
MOLECULAR WEIGHT: 458.53548
SMILES: COC1=CC=C(C=C1)N=N/C(=N\N2C(=O)C(SC2=N)CNC3=CC=CC=C3)/C4=CC=CC=C4
Structure:

CAS RN: 148022-37-1
CAS Name: 1-(propan-2-ylamino)-3-[(Z)-(3,7,7-trimethyl-4-bicyclo[4.1.0]heptanylidene)amino]oxy-2-propanol
OPENEYE Name: 1-(isopropylamino)-3-[(Z)-(4,7,7-trimethylnorcaran-3-ylidene)amino]oxy-propan-2-ol
IUPAC Name: 1-(propan-2-ylamino)-3-[(Z)-(3,7,7-trimethyl-4-bicyclo[4.1.0]heptanylidene)amino]oxypropan-2-ol
SYSTEMATIC NAME: 1-(propan-2-ylamino)-3-[(Z)-(3,7,7-trimethyl-4-bicyclo[4.1.0]heptanylidene)amino]oxy-propan-2-ol
MOLECULAR FORMULA: C16H30N2O2
MOLECULAR WEIGHT: 282.4216
SMILES: CC\1CC2C(C2(C)C)C/C1=N/OCC(CNC(C)C)O
Structure:

CAS RN: 85302-44-9
CAS Name: 1-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-[(4,5,7-trimethyl-2-oxo-1-benzopyran-8-yl)sulfonyl]urea
OPENEYE Name: 1-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-(4,5,7-trimethyl-2-oxo-chromen-8-yl)sulfonyl-urea
IUPAC Name: 1-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-(4,5,7-trimethyl-2-oxochromen-8-yl)sulfonylurea
SYSTEMATIC NAME: 1-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-(4,5,7-trimethyl-2-oxidanylidene-chromen-8-yl)sulfonyl-urea
MOLECULAR FORMULA: C21H22N4O5S
MOLECULAR WEIGHT: 442.48818
SMILES: CC1=CC(=C(C2=C1C(=CC(=O)O2)C)S(=O)(=O)NC(=O)N/N=C(/C)\C3=CC=C(C=C3)N)C
Structure:

CAS RN: 84859-09-6
CAS Name: N-(1,3-benzothiazol-2-yl)-1-methyl-2-piperidinimine
OPENEYE Name: N-(1,3-benzothiazol-2-yl)-1-methyl-piperidin-2-imine
IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-methylpiperidin-2-imine
SYSTEMATIC NAME: N-(1,3-benzothiazol-2-yl)-1-methyl-piperidin-2-imine
MOLECULAR FORMULA: C13H15N3S
MOLECULAR WEIGHT: 245.3433
SMILES: CN\1CCCC/C1=N/C2=NC3=CC=CC=C3S2
Structure:

CAS RN: 84859-08-5
CAS Name: N-(1,3-benzothiazol-2-yl)-1-ethyl-2-pyrrolidinimine
OPENEYE Name: N-(1,3-benzothiazol-2-yl)-1-ethyl-pyrrolidin-2-imine
IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-ethylpyrrolidin-2-imine
SYSTEMATIC NAME: N-(1,3-benzothiazol-2-yl)-1-ethyl-pyrrolidin-2-imine
MOLECULAR FORMULA: C13H15N3S
MOLECULAR WEIGHT: 245.3433
SMILES: CCN\1CCC/C1=N/C2=NC3=CC=CC=C3S2
Structure:

CAS RN: 84859-06-3
CAS Name: N-(1H-benzimidazol-2-yl)-1-methyl-2-azepanimine
OPENEYE Name: N-(1H-benzimidazol-2-yl)-1-methyl-azepan-2-imine
IUPAC Name: N-(1H-benzimidazol-2-yl)-1-methylazepan-2-imine
SYSTEMATIC NAME: N-(1H-benzimidazol-2-yl)-1-methyl-azepan-2-imine
MOLECULAR FORMULA: C14H18N4
MOLECULAR WEIGHT: 242.31952
SMILES: CN\1CCCCC/C1=N/C2=NC3=CC=CC=C3N2
Structure:

CAS RN: 84859-05-2
CAS Name: N-(1H-benzimidazol-2-yl)-1-methyl-2-piperidinimine
OPENEYE Name: N-(1H-benzimidazol-2-yl)-1-methyl-piperidin-2-imine
IUPAC Name: N-(1H-benzimidazol-2-yl)-1-methylpiperidin-2-imine
SYSTEMATIC NAME: N-(1H-benzimidazol-2-yl)-1-methyl-piperidin-2-imine
MOLECULAR FORMULA: C13H16N4
MOLECULAR WEIGHT: 228.29294
SMILES: CN\1CCCC/C1=N/C2=NC3=CC=CC=C3N2
Structure:

CAS RN: 84859-03-0
CAS Name: N-(1H-benzimidazol-2-yl)-1-ethyl-2-pyrrolidinimine
OPENEYE Name: N-(1H-benzimidazol-2-yl)-1-ethyl-pyrrolidin-2-imine
IUPAC Name: N-(1H-benzimidazol-2-yl)-1-ethylpyrrolidin-2-imine
SYSTEMATIC NAME: N-(1H-benzimidazol-2-yl)-1-ethyl-pyrrolidin-2-imine
MOLECULAR FORMULA: C13H16N4
MOLECULAR WEIGHT: 228.29294
SMILES: CCN\1CCC/C1=N/C2=NC3=CC=CC=C3N2
Structure:

CAS RN: 84640-95-9
CAS Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1,5-dimethyl-2-indolone
OPENEYE Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1,5-dimethyl-indolin-2-one
IUPAC Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1,5-dimethylindol-2-one
SYSTEMATIC NAME: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1,5-dimethyl-indol-2-one
MOLECULAR FORMULA: C18H13ClN4O2
MOLECULAR WEIGHT: 352.77442
SMILES: CC1=CC\2=C(C=C1)N(C(=O)/C2=N/C3=NN=C(O3)C4=CC=C(C=C4)Cl)C
Structure:

CAS RN: 84640-88-0
CAS Name: (3E)-5-chloro-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]-2-indolone
OPENEYE Name: (3E)-5-chloro-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indolin-2-one
IUPAC Name: (3E)-5-chloro-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
SYSTEMATIC NAME: (3E)-5-chloranyl-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
MOLECULAR FORMULA: C17H11ClN4O2
MOLECULAR WEIGHT: 338.74784
SMILES: CN1C2=C(C=C(C=C2)Cl)/C(=N\C3=NN=C(O3)C4=CC=CC=C4)/C1=O
Structure:

CAS RN: 84640-83-5
CAS Name: (3E)-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]-2-indolone
OPENEYE Name: (3E)-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indolin-2-one
IUPAC Name: (3E)-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
SYSTEMATIC NAME: (3E)-1-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
MOLECULAR FORMULA: C17H12N4O2
MOLECULAR WEIGHT: 304.30278
SMILES: CN1C2=CC=CC=C2/C(=N\C3=NN=C(O3)C4=CC=CC=C4)/C1=O
Structure:

CAS RN: 84640-79-9
CAS Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1-methyl-2-indolone
OPENEYE Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1-methyl-indolin-2-one
IUPAC Name: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1-methylindol-2-one
SYSTEMATIC NAME: (3E)-3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]imino]-1-methyl-indol-2-one
MOLECULAR FORMULA: C17H11ClN4O2
MOLECULAR WEIGHT: 338.74784
SMILES: CN1C2=CC=CC=C2/C(=N\C3=NN=C(O3)C4=CC=C(C=C4)Cl)/C1=O
Structure:

CAS RN: 84640-78-8
CAS Name: (3E)-1,5-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]-2-indolone
OPENEYE Name: (3E)-1,5-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indolin-2-one
IUPAC Name: (3E)-1,5-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
SYSTEMATIC NAME: (3E)-1,5-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]indol-2-one
MOLECULAR FORMULA: C18H14N4O2
MOLECULAR WEIGHT: 318.32936
SMILES: CC1=CC\2=C(C=C1)N(C(=O)/C2=N/C3=NN=C(O3)C4=CC=CC=C4)C
Structure:

CAS RN: 84603-46-3
CAS Name: (1Z)-N-[[methyl-[(2-phenyl-1,3-dioxan-5-yl)oxysulfinyl]amino]-oxomethoxy]ethanimidothioic acid methyl ester
OPENEYE Name: methyl (1Z)-N-[methyl-[(2-phenyl-1,3-dioxan-5-yl)oxysulfinyl]carbamoyl]oxyethanimidothioate
IUPAC Name: methyl (1Z)-N-[methyl-[(2-phenyl-1,3-dioxan-5-yl)oxysulfinyl]carbamoyl]oxyethanimidothioate
SYSTEMATIC NAME: methyl (1Z)-N-[methyl-[(2-phenyl-1,3-dioxan-5-yl)oxysulfinyl]carbamoyl]oxyethanimidothioate
MOLECULAR FORMULA: C15H20N2O6S2
MOLECULAR WEIGHT: 388.4591
SMILES: C/C(=N/OC(=O)N(C)S(=O)OC1COC(OC1)C2=CC=CC=C2)/SC
Structure:

CAS RN: 82332-16-9
CAS Name: 3-phenylpropanoic acid [(3Z,8R,9S,10R,13S,14S,17S)-3-hydroxyimino-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester
OPENEYE Name: [(3Z,8R,9S,10R,13S,14S,17S)-3-hydroxyimino-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-phenylpropanoate
IUPAC Name: [(3Z,8R,9S,10R,13S,14S,17S)-3-hydroxyimino-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-phenylpropanoate
SYSTEMATIC NAME: [(3Z,8R,9S,10R,13S,14S,17S)-3-hydroxyimino-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 3-phenylpropanoate
MOLECULAR FORMULA: C27H35NO3
MOLECULAR WEIGHT: 421.5717
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)CCC4=CC=CC=C4)CCC5=C/C(=N\O)/CC[C@H]35
Structure:

CAS RN: 81892-53-7
CAS Name: (4Z)-6-bromo-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
OPENEYE Name: (4Z)-6-bromo-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
IUPAC Name: (4Z)-6-bromo-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
SYSTEMATIC NAME: (4Z)-6-bromanyl-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
MOLECULAR FORMULA: C12H14BrN3O2
MOLECULAR WEIGHT: 312.16246
SMILES: CN(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Br
Structure:

CAS RN: 81892-52-6
CAS Name: (4Z)-6-chloro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
OPENEYE Name: (4Z)-6-chloro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
IUPAC Name: (4Z)-6-chloro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
SYSTEMATIC NAME: (4Z)-6-chloranyl-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
MOLECULAR FORMULA: C12H14ClN3O2
MOLECULAR WEIGHT: 267.71146
SMILES: CN(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Cl
Structure:

CAS RN: 81892-51-5
CAS Name: (4Z)-6-fluoro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
OPENEYE Name: (4Z)-6-fluoro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
IUPAC Name: (4Z)-6-fluoro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
SYSTEMATIC NAME: (4Z)-6-fluoranyl-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
MOLECULAR FORMULA: C12H14FN3O2
MOLECULAR WEIGHT: 251.256863
SMILES: CN(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)F
Structure:

CAS RN: 81892-50-4
CAS Name: (4Z)-6-bromo-4-hydroxyimino-N-methyl-2,3-dihydroquinoline-1-carboxamide
OPENEYE Name: (4Z)-6-bromo-4-hydroxyimino-N-methyl-2,3-dihydroquinoline-1-carboxamide
IUPAC Name: (4Z)-6-bromo-4-hydroxyimino-N-methyl-2,3-dihydroquinoline-1-carboxamide
SYSTEMATIC NAME: (4Z)-6-bromanyl-4-hydroxyimino-N-methyl-2,3-dihydroquinoline-1-carboxamide
MOLECULAR FORMULA: C11H12BrN3O2
MOLECULAR WEIGHT: 298.13588
SMILES: CNC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Br
Structure:

CAS RN: 81892-49-1
CAS Name: (E)-1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[(4Z)-6-bromanyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C18H15BrN2O2
MOLECULAR WEIGHT: 371.2279
SMILES: C\1CN(C2=C(/C1=N\O)C=C(C=C2)Br)C(=O)/C=C/C3=CC=CC=C3
Structure:

CAS RN: 81892-48-0
CAS Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-1-propanone
OPENEYE Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-propan-1-one
IUPAC Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methylpropan-1-one
SYSTEMATIC NAME: 1-[(4Z)-6-bromanyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-propan-1-one
MOLECULAR FORMULA: C13H15BrN2O2
MOLECULAR WEIGHT: 311.1744
SMILES: CC(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Br
Structure:

CAS RN: 81892-47-9
CAS Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-1-propanone
OPENEYE Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
IUPAC Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
SYSTEMATIC NAME: 1-[(4Z)-6-bromanyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
MOLECULAR FORMULA: C12H13BrN2O2
MOLECULAR WEIGHT: 297.14782
SMILES: CCC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Br
Structure:

CAS RN: 81892-46-8
CAS Name: 1-[(4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-1-propanone
OPENEYE Name: 1-[(4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
IUPAC Name: 1-[(4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
SYSTEMATIC NAME: 1-[(4Z)-6-fluoranyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]propan-1-one
MOLECULAR FORMULA: C12H13FN2O2
MOLECULAR WEIGHT: 236.242223
SMILES: CCC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)F
Structure:

CAS RN: 81892-44-6
CAS Name: (4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinoline-1-carboxylic acid ethyl ester
OPENEYE Name: ethyl (4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinoline-1-carboxylate
IUPAC Name: ethyl (4Z)-6-fluoro-4-hydroxyimino-2,3-dihydroquinoline-1-carboxylate
SYSTEMATIC NAME: ethyl (4Z)-6-fluoranyl-4-hydroxyimino-2,3-dihydroquinoline-1-carboxylate
MOLECULAR FORMULA: C12H13FN2O3
MOLECULAR WEIGHT: 252.241623
SMILES: CCOC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)F
Structure:

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