Thursday, June 28, 2012

http://ChemLookup.com Compounds




CAS RN: 43021-10-9
CAS Name: N-[4-(benzenesulfonamido)-3-[methoxy(diphenyl)methyl]phenyl]benzenesulfonamide
OPENEYE Name: N-[4-(benzenesulfonamido)-3-[methoxy(diphenyl)methyl]phenyl]benzenesulfonamide
IUPAC Name: N-[4-(benzenesulfonamido)-3-[methoxy(diphenyl)methyl]phenyl]benzenesulfonamide
SYSTEMATIC NAME: N-[3-[methoxy(diphenyl)methyl]-4-(phenylsulfonylamino)phenyl]benzenesulfonamide
MOLECULAR FORMULA: C32H28N2O5S2
MOLECULAR WEIGHT: 584.70512
SMILES: COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)NS(=O)(=O)C5=CC=CC=C5
Structure:

CAS RN: 4132-55-2
CAS Name: 9-xanthenone hydrazone
OPENEYE Name: xanthen-9-one hydrazone
IUPAC Name: xanthen-9-ylidenehydrazine
SYSTEMATIC NAME: xanthen-9-ylidenediazane
MOLECULAR FORMULA: C13H10N2O
MOLECULAR WEIGHT: 210.2313
SMILES: C1=CC=C2C(=C1)C(=NN)C3=CC=CC=C3O2
Structure:

CAS RN: 68756-01-4
CAS Name: 2-(2-furanyl)-2-[(2,4,6-trimethylphenyl)sulfonylhydrazinylidene]acetic acid ethyl ester
OPENEYE Name: ethyl 2-(2-furyl)-2-[(2,4,6-trimethylphenyl)sulfonylhydrazono]acetate
IUPAC Name: ethyl 2-(furan-2-yl)-2-[(2,4,6-trimethylphenyl)sulfonylhydrazinylidene]acetate
SYSTEMATIC NAME: ethyl 2-(furan-2-yl)-2-[(2,4,6-trimethylphenyl)sulfonylhydrazinylidene]ethanoate
MOLECULAR FORMULA: C17H20N2O5S
MOLECULAR WEIGHT: 364.4161
SMILES: CCOC(=O)C(=NNS(=O)(=O)C1=C(C=C(C=C1C)C)C)C2=CC=CO2
Structure:

CAS RN: 22816-01-9
CAS Name: 5-phenyl-1,3,4-oxadiazole-2-carboxaldehyde
OPENEYE Name: 5-phenyl-1,3,4-oxadiazole-2-carbaldehyde
IUPAC Name: 5-phenyl-1,3,4-oxadiazole-2-carbaldehyde
SYSTEMATIC NAME: 5-phenyl-1,3,4-oxadiazole-2-carbaldehyde
MOLECULAR FORMULA: C9H6N2O2
MOLECULAR WEIGHT: 174.15614
SMILES: C1=CC=C(C=C1)C2=NN=C(O2)C=O
Structure:

CAS RN: 36331-50-7
CAS Name: 4-methyl-N-(3-thiophenylmethylideneamino)benzenesulfonamide
OPENEYE Name: 4-methyl-N-(3-thienylmethyleneamino)benzenesulfonamide
IUPAC Name: 4-methyl-N-(thiophen-3-ylmethylideneamino)benzenesulfonamide
SYSTEMATIC NAME: 4-methyl-N-(thiophen-3-ylmethylideneamino)benzenesulfonamide
MOLECULAR FORMULA: C12H12N2O2S2
MOLECULAR WEIGHT: 280.36588
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CSC=C2
Structure:

CAS RN: 54288-46-9
CAS Name: N-(2,2-diphenylpropylideneamino)-4-methylbenzenesulfonamide
OPENEYE Name: N-(2,2-diphenylpropylideneamino)-4-methyl-benzenesulfonamide
IUPAC Name: N-(2,2-diphenylpropylideneamino)-4-methylbenzenesulfonamide
SYSTEMATIC NAME: N-(2,2-diphenylpropylideneamino)-4-methyl-benzenesulfonamide
MOLECULAR FORMULA: C22H22N2O2S
MOLECULAR WEIGHT: 378.48728
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=CC(C)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 40691-65-4
CAS Name: N-(2,2-diphenylpropyl)carbamic acid ethyl ester
OPENEYE Name: ethyl N-(2,2-diphenylpropyl)carbamate
IUPAC Name: ethyl N-(2,2-diphenylpropyl)carbamate
SYSTEMATIC NAME: ethyl N-(2,2-diphenylpropyl)carbamate
MOLECULAR FORMULA: C18H21NO2
MOLECULAR WEIGHT: 283.36484
SMILES: CCOC(=O)NCC(C)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 10558-25-5
CAS Name: 4-bromo-3,5-dimethylisoxazole
OPENEYE Name: 4-bromo-3,5-dimethyl-isoxazole
IUPAC Name: 4-bromo-3,5-dimethyl-1,2-oxazole
SYSTEMATIC NAME: 4-bromanyl-3,5-dimethyl-1,2-oxazole
MOLECULAR FORMULA: C5H6BrNO
MOLECULAR WEIGHT: 176.01124
SMILES: CC1=C(C(=NO1)C)Br
Structure:

CAS RN: 23012-25-1
CAS Name: 1-(2,4-dimethyl-5-oxazolyl)ethanone
OPENEYE Name: 1-(2,4-dimethyloxazol-5-yl)ethanone
IUPAC Name: 1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone
SYSTEMATIC NAME: 1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone
MOLECULAR FORMULA: C7H9NO2
MOLECULAR WEIGHT: 139.15186
SMILES: CC1=C(OC(=N1)C)C(=O)C
Structure:

CAS RN: 838-13-1
CAS Name: 4-[hydrazinylidene(phenyl)methyl]benzonitrile
OPENEYE Name: 4-(phenylcarbonohydrazonoyl)benzonitrile
IUPAC Name: 4-(C-phenylcarbonohydrazonoyl)benzonitrile
SYSTEMATIC NAME: 4-(C-phenylcarbonohydrazonoyl)benzenecarbonitrile
MOLECULAR FORMULA: C14H11N3
MOLECULAR WEIGHT: 221.25724
SMILES: C1=CC=C(C=C1)C(=NN)C2=CC=C(C=C2)C#N
Structure:

CAS RN: 38395-64-1
CAS Name: (4-methoxyphenyl)-phenylmethanone hydrazone
OPENEYE Name: (4-methoxyphenyl)-phenyl-methanone hydrazone
IUPAC Name: [(4-methoxyphenyl)-phenylmethylidene]hydrazine
SYSTEMATIC NAME: [(4-methoxyphenyl)-phenyl-methylidene]diazane
MOLECULAR FORMULA: C14H14N2O
MOLECULAR WEIGHT: 226.27376
SMILES: COC1=CC=C(C=C1)C(=NN)C2=CC=CC=C2
Structure:

CAS RN: 68724-26-5
CAS Name: (4-methylsulfonylphenyl)-phenylmethanone hydrazone
OPENEYE Name: (4-methylsulfonylphenyl)-phenyl-methanone hydrazone
IUPAC Name: [(4-methylsulfonylphenyl)-phenylmethylidene]hydrazine
SYSTEMATIC NAME: [(4-methylsulfonylphenyl)-phenyl-methylidene]diazane
MOLECULAR FORMULA: C14H14N2O2S
MOLECULAR WEIGHT: 274.33816
SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2
Structure:

CAS RN: 7714-12-7
CAS Name: 2-methoxy-1-(4-nitrophenyl)ethanone
OPENEYE Name: 2-methoxy-1-(4-nitrophenyl)ethanone
IUPAC Name: 2-methoxy-1-(4-nitrophenyl)ethanone
SYSTEMATIC NAME: 2-methoxy-1-(4-nitrophenyl)ethanone
MOLECULAR FORMULA: C9H9NO4
MOLECULAR WEIGHT: 195.17206
SMILES: COCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:

CAS RN: 30780-45-1
CAS Name: 1-(4-chlorophenyl)-2-methoxyethanone
OPENEYE Name: 1-(4-chlorophenyl)-2-methoxy-ethanone
IUPAC Name: 1-(4-chlorophenyl)-2-methoxyethanone
SYSTEMATIC NAME: 1-(4-chlorophenyl)-2-methoxy-ethanone
MOLECULAR FORMULA: C9H9ClO2
MOLECULAR WEIGHT: 184.61956
SMILES: COCC(=O)C1=CC=C(C=C1)Cl
Structure:

CAS RN: 5211-35-8
CAS Name: acetic acid 2-[(2,4,5-trichlorophenyl)sulfonylhydrazinylidene]propyl ester
OPENEYE Name: 2-[(2,4,5-trichlorophenyl)sulfonylhydrazono]propyl acetate
IUPAC Name: 2-[(2,4,5-trichlorophenyl)sulfonylhydrazinylidene]propyl acetate
SYSTEMATIC NAME: 2-[[2,4,5-tris(chloranyl)phenyl]sulfonylhydrazinylidene]propyl ethanoate
MOLECULAR FORMULA: C11H11Cl3N2O4S
MOLECULAR WEIGHT: 373.64004
SMILES: CC(=NNS(=O)(=O)C1=CC(=C(C=C1Cl)Cl)Cl)COC(=O)C
Structure:

CAS RN: 1631-16-9
CAS Name: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
OPENEYE Name: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
IUPAC Name: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
SYSTEMATIC NAME: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
MOLECULAR FORMULA: C15H31N3
MOLECULAR WEIGHT: 253.42674
SMILES: CC(C)(C)C1NC(N2N1C2C(C)(C)C)C(C)(C)C
Structure:

CAS RN: 5373-91-1
CAS Name: 4-(4-methoxy-4-oxobutoxy)butanoic acid methyl ester
OPENEYE Name: methyl 4-(4-methoxy-4-oxo-butoxy)butanoate
IUPAC Name: methyl 4-(4-methoxy-4-oxobutoxy)butanoate
SYSTEMATIC NAME: methyl 4-(4-methoxy-4-oxidanylidene-butoxy)butanoate
MOLECULAR FORMULA: C10H18O5
MOLECULAR WEIGHT: 218.24692
SMILES: COC(=O)CCCOCCCC(=O)OC
Structure:

CAS RN: 3846-07-9
CAS Name: 1,4,5,8-tetrahydronaphthalene-4a,8a-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 1,4,5,8-tetrahydronaphthalene-4a,8a-dicarboxylate
IUPAC Name: dimethyl 1,4,5,8-tetrahydronaphthalene-4a,8a-dicarboxylate
SYSTEMATIC NAME: dimethyl 1,4,5,8-tetrahydronaphthalene-4a,8a-dicarboxylate
MOLECULAR FORMULA: C14H18O4
MOLECULAR WEIGHT: 250.29032
SMILES: COC(=O)C12CC=CCC1(CC=CC2)C(=O)OC
Structure:

CAS RN: 6580-23-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H14O2
MOLECULAR WEIGHT: 262.30256
SMILES: COC(=O)C12C3C(C3C4=CC=CC=C41)C5=CC=CC=C25
Structure:

CAS RN: 70421-26-0
CAS Name: 2-(hydroxymethyl)-5-(4-methoxy-1-pyrazolo[3,4-d]pyrimidinyl)oxolane-3,4-diol
OPENEYE Name: 2-(hydroxymethyl)-5-(4-methoxypyrazolo[3,4-d]pyrimidin-1-yl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(hydroxymethyl)-5-(4-methoxypyrazolo[3,4-d]pyrimidin-1-yl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-(4-methoxypyrazolo[3,4-d]pyrimidin-1-yl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H14N4O5
MOLECULAR WEIGHT: 282.25266
SMILES: COC1=NC=NC2=C1C=NN2C3C(C(C(O3)CO)O)O
Structure:

CAS RN: 64372-75-4
CAS Name: 2-[4-(dimethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C12H17N5O4
MOLECULAR WEIGHT: 295.29448
SMILES: CN(C)C1=NC=NC2=C1C=NN2C3C(C(C(O3)CO)O)O
Structure:

CAS RN: 64372-74-3
CAS Name: 2-(hydroxymethyl)-5-[4-(methylamino)-1-pyrazolo[3,4-d]pyrimidinyl]oxolane-3,4-diol
OPENEYE Name: 2-(hydroxymethyl)-5-[4-(methylamino)pyrazolo[3,4-d]pyrimidin-1-yl]tetrahydrofuran-3,4-diol
IUPAC Name: 2-(hydroxymethyl)-5-[4-(methylamino)pyrazolo[3,4-d]pyrimidin-1-yl]oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-[4-(methylamino)pyrazolo[3,4-d]pyrimidin-1-yl]oxolane-3,4-diol
MOLECULAR FORMULA: C11H15N5O4
MOLECULAR WEIGHT: 281.2679
SMILES: CNC1=NC=NC2=C1C=NN2C3C(C(C(O3)CO)O)O
Structure:

CAS RN: 64101-98-0
CAS Name: 2,3-dimethoxy-5-(tetradecylthio)cyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 2,3-dimethoxy-5-tetradecylsulfanyl-1,4-benzoquinone
IUPAC Name: 2,3-dimethoxy-5-tetradecylsulfanylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,3-dimethoxy-5-tetradecylsulfanyl-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C22H36O4S
MOLECULAR WEIGHT: 396.58384
SMILES: CCCCCCCCCCCCCCSC1=CC(=O)C(=C(C1=O)OC)OC
Structure:

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