Saturday, July 30, 2011

http://ChemLookup.com Compounds




CAS RN: 20302-79-8
CAS Name: 6-(1,3-benzodioxol-5-yl)-1-cyclohex-3-enamine hydrochloride
OPENEYE Name: 6-(1,3-benzodioxol-5-yl)cyclohex-3-en-1-amine hydrochloride
IUPAC Name: 6-(1,3-benzodioxol-5-yl)cyclohex-3-en-1-amine hydrochloride
SYSTEMATIC NAME: 6-(1,3-benzodioxol-5-yl)cyclohex-3-en-1-amine hydrochloride
MOLECULAR FORMULA: C13H16ClNO2
MOLECULAR WEIGHT: 253.72464
SMILES: C1C=CCC(C1C2=CC3=C(C=C2)OCO3)N.Cl
Structure:

CAS RN: 21691-17-8
CAS Name: (N1E,N2E)-N1,N2-didiazobenzene-1,2-disulfonamide
OPENEYE Name: (N1E,N2E)-N1,N2-didiazobenzene-1,2-disulfonamide
IUPAC Name: (N1E,N2E)-1-N,2-N-didiazobenzene-1,2-disulfonamide
SYSTEMATIC NAME: (N1E,N2E)-N1,N2-didiazobenzene-1,2-disulfonamide
MOLECULAR FORMULA: C6H4N6O4S2
MOLECULAR WEIGHT: 288.26376
SMILES: C1=CC=C(C(=C1)S(=O)(=O)N=[N+]=[N-])S(=O)(=O)N=[N+]=[N-]
Structure:

CAS RN: 20914-58-3
CAS Name: 9-[5-(diethylamino)pentan-2-ylamino]-3H-purine-6-thione hydrobromide
OPENEYE Name: 9-[[4-(diethylamino)-1-methyl-butyl]amino]-3H-purine-6-thione hydrobromide
IUPAC Name: 9-[5-(diethylamino)pentan-2-ylamino]-3H-purine-6-thione hydrobromide
SYSTEMATIC NAME: 9-[5-(diethylamino)pentan-2-ylamino]-3H-purine-6-thione hydrobromide
MOLECULAR FORMULA: C14H25BrN6S
MOLECULAR WEIGHT: 389.3575
SMILES: CCN(CC)CCCC(C)NN1C=NC2=C1NC=NC2=S.Br
Structure:

CAS RN: 28642-78-6
CAS Name: 3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazine-6,8-diamine hydrochloride
OPENEYE Name: 3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazine-6,8-diamine hydrochloride
IUPAC Name: 3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazine-6,8-diamine hydrochloride
SYSTEMATIC NAME: 3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazine-6,8-diamine hydrochloride
MOLECULAR FORMULA: C16H18ClN5O3
MOLECULAR WEIGHT: 363.79882
SMILES: COC1=CC(=CC(=C1OC)OC)C2=CN=C3C(=CC(=NC3=N2)N)N.Cl
Structure:

CAS RN: 7133-49-5
CAS Name: 1,2-dihydrothiazolo[2,3-b][1,3]benzothiazol-9-ium bromide
OPENEYE Name: 1,2-dihydrothiazolo[2,3-b][1,3]benzothiazol-9-ium bromide
IUPAC Name: 1,2-dihydro-[1,3]thiazolo[2,3-b][1,3]benzothiazol-9-ium bromide
SYSTEMATIC NAME: 1,2-dihydro-[1,3]thiazolo[2,3-b][1,3]benzothiazol-9-ium bromide
MOLECULAR FORMULA: C9H8BrNS2
MOLECULAR WEIGHT: 274.20052
SMILES: C1CSC2=[N+]1C3=CC=CC=C3S2.[Br-]
Structure:

CAS RN: 54272-12-7
CAS Name: (1E)-1-ethoxyimino-2-(sulfothio)cyclohexane; sodium
OPENEYE Name: (1E)-1-ethoxyimino-2-sulfosulfanyl-cyclohexane; sodium
IUPAC Name: (1E)-1-ethoxyimino-2-sulfosulfanylcyclohexane; sodium
SYSTEMATIC NAME: (1E)-1-ethoxyimino-2-sulfosulfanyl-cyclohexane; sodium
MOLECULAR FORMULA: C8H15NNaO4S2
MOLECULAR WEIGHT: 276.32877
SMILES: CCO/N=C/1\CCCCC1SS(=O)(=O)O.[Na]
Structure:

CAS RN: 31377-01-2
CAS Name: [(1Z)-1-ethoxyimino-2-(sulfothio)ethyl]benzene; sodium
OPENEYE Name: [(Z)-N-ethoxy-C-(sulfosulfanylmethyl)carbonimidoyl]benzene; sodium
IUPAC Name: [(Z)-N-ethoxy-C-(sulfosulfanylmethyl)carbonimidoyl]benzene; sodium
SYSTEMATIC NAME: [(Z)-N-ethoxy-C-(sulfosulfanylmethyl)carbonimidoyl]benzene; sodium
MOLECULAR FORMULA: C10H13NNaO4S2
MOLECULAR WEIGHT: 298.33429
SMILES: CCO/N=C(\CSS(=O)(=O)O)/C1=CC=CC=C1.[Na]
Structure:

CAS RN: 54272-11-6
CAS Name: (1E)-1-ethoxyimino-2-(sulfothio)cyclopentane; sodium
OPENEYE Name: (1E)-1-ethoxyimino-2-sulfosulfanyl-cyclopentane; sodium
IUPAC Name: (1E)-1-ethoxyimino-2-sulfosulfanylcyclopentane; sodium
SYSTEMATIC NAME: (1E)-1-ethoxyimino-2-sulfosulfanyl-cyclopentane; sodium
MOLECULAR FORMULA: C7H13NNaO4S2
MOLECULAR WEIGHT: 262.30219
SMILES: CCO/N=C/1\CCCC1SS(=O)(=O)O.[Na]
Structure:

CAS RN: 54272-10-5
CAS Name: 2-ethoxyimino-3-(sulfothio)butane; sodium
OPENEYE Name: 2-ethoxyimino-3-sulfosulfanyl-butane; sodium
IUPAC Name: 2-ethoxyimino-3-sulfosulfanylbutane; sodium
SYSTEMATIC NAME: 2-ethoxyimino-3-sulfosulfanyl-butane; sodium
MOLECULAR FORMULA: C6H13NNaO4S2
MOLECULAR WEIGHT: 250.29149
SMILES: CCON=C(C)C(C)SS(=O)(=O)O.[Na]
Structure:

CAS RN: 54272-09-2
CAS Name: 2-ethoxyimino-1-(sulfothio)propane; sodium
OPENEYE Name: 2-ethoxyimino-1-sulfosulfanyl-propane; sodium
IUPAC Name: 2-ethoxyimino-1-sulfosulfanylpropane; sodium
SYSTEMATIC NAME: 2-ethoxyimino-1-sulfosulfanyl-propane; sodium
MOLECULAR FORMULA: C5H11NNaO4S2
MOLECULAR WEIGHT: 236.26491
SMILES: CCON=C(C)CSS(=O)(=O)O.[Na]
Structure:

CAS RN: 5445-03-4
CAS Name: 5-(2-amino-4,5-dimethylanilino)pentane-1,2,3,4-tetrol hydrochloride
OPENEYE Name: 5-(2-amino-4,5-dimethyl-anilino)pentane-1,2,3,4-tetrol hydrochloride
IUPAC Name: 5-(2-amino-4,5-dimethylanilino)pentane-1,2,3,4-tetrol hydrochloride
SYSTEMATIC NAME: 5-[(2-azanyl-4,5-dimethyl-phenyl)amino]pentane-1,2,3,4-tetrol hydrochloride
MOLECULAR FORMULA: C13H23ClN2O4
MOLECULAR WEIGHT: 306.78572
SMILES: CC1=CC(=C(C=C1C)NCC(C(C(CO)O)O)O)N.Cl
Structure:

CAS RN: 71799-94-5
CAS Name: potassium; sulfuric acid (6-bromo-2-naphthalenyl) ester
OPENEYE Name: (6-bromo-2-naphthyl) hydrogen sulfate; potassium
IUPAC Name: (6-bromonaphthalen-2-yl) hydrogen sulfate; potassium
SYSTEMATIC NAME: (6-bromanylnaphthalen-2-yl) hydrogen sulfate; potassium
MOLECULAR FORMULA: C10H7BrKO4S
MOLECULAR WEIGHT: 342.22748
SMILES: C1=CC2=C(C=CC(=C2)Br)C=C1OS(=O)(=O)O.[K]
Structure:

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