Friday, December 30, 2011

http://ChemLookup.com Compounds




CAS RN: 58544-43-7
CAS Name: 4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine
OPENEYE Name: 4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine
IUPAC Name: 4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine
SYSTEMATIC NAME: 4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine
MOLECULAR FORMULA: C9H13N3
MOLECULAR WEIGHT: 163.21962
SMILES: CC1=NC(=NC2=C1CCCC2)N
Structure:

CAS RN: 21417-18-5
CAS Name: 2-chloro-N-(1-cyclohexenyl)-N-ethylacetamide
OPENEYE Name: 2-chloro-N-(cyclohexen-1-yl)-N-ethyl-acetamide
IUPAC Name: 2-chloro-N-(cyclohexen-1-yl)-N-ethylacetamide
SYSTEMATIC NAME: 2-chloranyl-N-(cyclohexen-1-yl)-N-ethyl-ethanamide
MOLECULAR FORMULA: C10H16ClNO
MOLECULAR WEIGHT: 201.69314
SMILES: CCN(C1=CCCCC1)C(=O)CCl
Structure:

CAS RN: 112794-29-3
CAS Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide
OPENEYE Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide
SYSTEMATIC NAME: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide
MOLECULAR FORMULA: C10H12N2O
MOLECULAR WEIGHT: 176.21508
SMILES: C1C(NCC2=CC=CC=C21)C(=O)N
Structure:

CAS RN: 3524-18-3
CAS Name: 2-(2-methylpropyl)-3-pyrazolamine
OPENEYE Name: 2-isobutylpyrazol-3-amine
IUPAC Name: 2-(2-methylpropyl)pyrazol-3-amine
SYSTEMATIC NAME: 2-(2-methylpropyl)pyrazol-3-amine
MOLECULAR FORMULA: C7H13N3
MOLECULAR WEIGHT: 139.19822
SMILES: CC(C)CN1C(=CC=N1)N
Structure:

CAS RN: 103026-02-4
CAS Name: 2-amino-1-(2-furanylmethyl)-4,5-dimethyl-3-pyrrolecarbonitrile
OPENEYE Name: 2-amino-1-(2-furylmethyl)-4,5-dimethyl-pyrrole-3-carbonitrile
IUPAC Name: 2-amino-1-(furan-2-ylmethyl)-4,5-dimethylpyrrole-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrole-3-carbonitrile
MOLECULAR FORMULA: C12H13N3O
MOLECULAR WEIGHT: 215.25112
SMILES: CC1=C(N(C(=C1C#N)N)CC2=CC=CO2)C
Structure:

CAS RN: 55817-74-8
CAS Name: 2-amino-1-cyclohexyl-4,5-dimethyl-3-pyrrolecarbonitrile
OPENEYE Name: 2-amino-1-cyclohexyl-4,5-dimethyl-pyrrole-3-carbonitrile
IUPAC Name: 2-amino-1-cyclohexyl-4,5-dimethylpyrrole-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-cyclohexyl-4,5-dimethyl-pyrrole-3-carbonitrile
MOLECULAR FORMULA: C13H19N3
MOLECULAR WEIGHT: 217.31006
SMILES: CC1=C(N(C(=C1C#N)N)C2CCCCC2)C
Structure:

CAS RN: 86662-57-9
CAS Name: 3-ethyl-2-hydrazinyl-4-quinazolinone
OPENEYE Name: 3-ethyl-2-hydrazino-quinazolin-4-one
IUPAC Name: 3-ethyl-2-hydrazinylquinazolin-4-one
SYSTEMATIC NAME: 2-diazanyl-3-ethyl-quinazolin-4-one
MOLECULAR FORMULA: C10H12N4O
MOLECULAR WEIGHT: 204.22848
SMILES: CCN1C(=O)C2=CC=CC=C2N=C1NN
Structure:

CAS RN: 50911-71-2
CAS Name: 2-chloro-N-[2-(3-methylphenoxy)ethyl]acetamide
OPENEYE Name: 2-chloro-N-[2-(3-methylphenoxy)ethyl]acetamide
IUPAC Name: 2-chloro-N-[2-(3-methylphenoxy)ethyl]acetamide
SYSTEMATIC NAME: 2-chloranyl-N-[2-(3-methylphenoxy)ethyl]ethanamide
MOLECULAR FORMULA: C11H14ClNO2
MOLECULAR WEIGHT: 227.68736
SMILES: CC1=CC(=CC=C1)OCCNC(=O)CCl
Structure:

CAS RN: 14903-94-7
CAS Name: 6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl 6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
IUPAC Name: ethyl 6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 6-(bromomethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C8H11BrN2O3
MOLECULAR WEIGHT: 263.08854
SMILES: CCOC(=O)C1=C(NC(=O)NC1)CBr
Structure:

CAS RN: 21417-17-4
CAS Name: 2-chloro-N-(1-cyclohexenyl)-N-propylacetamide
OPENEYE Name: 2-chloro-N-(cyclohexen-1-yl)-N-propyl-acetamide
IUPAC Name: 2-chloro-N-(cyclohexen-1-yl)-N-propylacetamide
SYSTEMATIC NAME: 2-chloranyl-N-(cyclohexen-1-yl)-N-propyl-ethanamide
MOLECULAR FORMULA: C11H18ClNO
MOLECULAR WEIGHT: 215.71972
SMILES: CCCN(C1=CCCCC1)C(=O)CCl
Structure:

CAS RN: 53981-38-7
CAS Name: 3,4-dihydro-2H-1-benzopyran-4-amine
OPENEYE Name: chroman-4-amine
IUPAC Name: 3,4-dihydro-2H-chromen-4-amine
SYSTEMATIC NAME: 3,4-dihydro-2H-chromen-4-amine
MOLECULAR FORMULA: C9H11NO
MOLECULAR WEIGHT: 149.18974
SMILES: C1COC2=CC=CC=C2C1N
Structure:

CAS RN: 188198-38-1
CAS Name: 3,4-dihydro-2H-1-benzopyran-4-amine
OPENEYE Name: chroman-4-amine
IUPAC Name: 3,4-dihydro-2H-chromen-4-amine
SYSTEMATIC NAME: 3,4-dihydro-2H-chromen-4-amine
MOLECULAR FORMULA: C9H11NO
MOLECULAR WEIGHT: 149.18974
SMILES: C1COC2=CC=CC=C2C1N
Structure:

CAS RN: 210488-55-4
CAS Name: 3,4-dihydro-2H-1-benzopyran-4-amine
OPENEYE Name: chroman-4-amine
IUPAC Name: 3,4-dihydro-2H-chromen-4-amine
SYSTEMATIC NAME: 3,4-dihydro-2H-chromen-4-amine
MOLECULAR FORMULA: C9H11NO
MOLECULAR WEIGHT: 149.18974
SMILES: C1COC2=CC=CC=C2C1N
Structure:

CAS RN: 83548-60-1
CAS Name: 4-chloro-5,6-dimethyl-2-phenylthieno[2,3-d]pyrimidine
OPENEYE Name: 4-chloro-5,6-dimethyl-2-phenyl-thieno[2,3-d]pyrimidine
IUPAC Name: 4-chloro-5,6-dimethyl-2-phenylthieno[2,3-d]pyrimidine
SYSTEMATIC NAME: 4-chloranyl-5,6-dimethyl-2-phenyl-thieno[2,3-d]pyrimidine
MOLECULAR FORMULA: C14H11ClN2S
MOLECULAR WEIGHT: 274.76854
SMILES: CC1=C(SC2=C1C(=NC(=N2)C3=CC=CC=C3)Cl)C
Structure:

CAS RN: 100142-87-8
CAS Name: 4-(4-aminophenyl)benzenesulfonamide
OPENEYE Name: 4-(4-aminophenyl)benzenesulfonamide
IUPAC Name: 4-(4-aminophenyl)benzenesulfonamide
SYSTEMATIC NAME: 4-(4-aminophenyl)benzenesulfonamide
MOLECULAR FORMULA: C12H12N2O2S
MOLECULAR WEIGHT: 248.30088
SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)N)N
Structure:

CAS RN: 50850-95-8
CAS Name: 5,6-diethoxy-1,3-benzothiazol-2-amine
OPENEYE Name: 5,6-diethoxy-1,3-benzothiazol-2-amine
IUPAC Name: 5,6-diethoxy-1,3-benzothiazol-2-amine
SYSTEMATIC NAME: 5,6-diethoxy-1,3-benzothiazol-2-amine
MOLECULAR FORMULA: C11H14N2O2S
MOLECULAR WEIGHT: 238.30606
SMILES: CCOC1=C(C=C2C(=C1)N=C(S2)N)OCC
Structure:

CAS RN: 101251-33-6
CAS Name: 3-amino-4,5-dimethylbenzenesulfonamide
OPENEYE Name: 3-amino-4,5-dimethyl-benzenesulfonamide
IUPAC Name: 3-amino-4,5-dimethylbenzenesulfonamide
SYSTEMATIC NAME: 3-azanyl-4,5-dimethyl-benzenesulfonamide
MOLECULAR FORMULA: C8H12N2O2S
MOLECULAR WEIGHT: 200.25808
SMILES: CC1=CC(=CC(=C1C)N)S(=O)(=O)N
Structure:

CAS RN: 91062-48-5
CAS Name: 5-bromo-2-(4-morpholinyl)aniline
OPENEYE Name: 5-bromo-2-morpholino-aniline
IUPAC Name: 5-bromo-2-morpholin-4-ylaniline
SYSTEMATIC NAME: 5-bromanyl-2-morpholin-4-yl-aniline
MOLECULAR FORMULA: C10H13BrN2O
MOLECULAR WEIGHT: 257.12702
SMILES: C1COCCN1C2=C(C=C(C=C2)Br)N
Structure:

CAS RN: 69746-86-7
CAS Name: 2-chloro-1-(2,5-dibromo-3-thiophenyl)ethanone
OPENEYE Name: 2-chloro-1-(2,5-dibromo-3-thienyl)ethanone
IUPAC Name: 2-chloro-1-(2,5-dibromothiophen-3-yl)ethanone
SYSTEMATIC NAME: 1-[2,5-bis(bromanyl)thiophen-3-yl]-2-chloranyl-ethanone
MOLECULAR FORMULA: C6H3Br2ClOS
MOLECULAR WEIGHT: 318.41342
SMILES: C1=C(SC(=C1C(=O)CCl)Br)Br
Structure:

CAS RN: 110698-60-7
CAS Name: (4-aminophenyl)-(1-methyl-2-imidazolyl)methanone
OPENEYE Name: (4-aminophenyl)-(1-methylimidazol-2-yl)methanone
IUPAC Name: (4-aminophenyl)-(1-methylimidazol-2-yl)methanone
SYSTEMATIC NAME: (4-aminophenyl)-(1-methylimidazol-2-yl)methanone
MOLECULAR FORMULA: C11H11N3O
MOLECULAR WEIGHT: 201.22454
SMILES: CN1C=CN=C1C(=O)C2=CC=C(C=C2)N
Structure:

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