Wednesday, January 25, 2012

http://ChemLookup.com Compounds




CAS RN: 161199-96-8
CAS Name: 1-(3,4-diethoxyphenyl)-3-(dimethylamino)-1-propanone hydrochloride
OPENEYE Name: 1-(3,4-diethoxyphenyl)-3-(dimethylamino)propan-1-one hydrochloride
IUPAC Name: 1-(3,4-diethoxyphenyl)-3-(dimethylamino)propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(3,4-diethoxyphenyl)-3-(dimethylamino)propan-1-one hydrochloride
MOLECULAR FORMULA: C15H24ClNO3
MOLECULAR WEIGHT: 301.80896
SMILES: CCOC1=C(C=C(C=C1)C(=O)CCN(C)C)OCC.Cl
Structure:

CAS RN: 161199-95-7
CAS Name: 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-1-propanone hydrochloride
OPENEYE Name: 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxy-phenyl)propan-1-one hydrochloride
IUPAC Name: 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)propan-1-one hydrochloride
SYSTEMATIC NAME: 3-(dimethylamino)-1-(2-fluoranyl-4,5-dimethoxy-phenyl)propan-1-one hydrochloride
MOLECULAR FORMULA: C13H19ClFNO3
MOLECULAR WEIGHT: 291.746263
SMILES: CN(C)CCC(=O)C1=CC(=C(C=C1F)OC)OC.Cl
Structure:

CAS RN: 161199-94-6
CAS Name: 1-(2-chloro-4,5-dimethoxyphenyl)-3-(dimethylamino)-1-propanone hydrochloride
OPENEYE Name: 1-(2-chloro-4,5-dimethoxy-phenyl)-3-(dimethylamino)propan-1-one hydrochloride
IUPAC Name: 1-(2-chloro-4,5-dimethoxyphenyl)-3-(dimethylamino)propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(2-chloranyl-4,5-dimethoxy-phenyl)-3-(dimethylamino)propan-1-one hydrochloride
MOLECULAR FORMULA: C13H19Cl2NO3
MOLECULAR WEIGHT: 308.20086
SMILES: CN(C)CCC(=O)C1=CC(=C(C=C1Cl)OC)OC.Cl
Structure:

CAS RN: 161199-93-5
CAS Name: 1-(2-bromo-4,5-dimethoxyphenyl)-3-(dimethylamino)-1-propanone hydrochloride
OPENEYE Name: 1-(2-bromo-4,5-dimethoxy-phenyl)-3-(dimethylamino)propan-1-one hydrochloride
IUPAC Name: 1-(2-bromo-4,5-dimethoxyphenyl)-3-(dimethylamino)propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(2-bromanyl-4,5-dimethoxy-phenyl)-3-(dimethylamino)propan-1-one hydrochloride
MOLECULAR FORMULA: C13H19BrClNO3
MOLECULAR WEIGHT: 352.65186
SMILES: CN(C)CCC(=O)C1=CC(=C(C=C1Br)OC)OC.Cl
Structure:

CAS RN: 161193-03-9
CAS Name: 2-acetyloxy-4-(methylthio)butanoic acid
OPENEYE Name: 2-acetoxy-4-methylsulfanyl-butanoic acid
IUPAC Name: 2-acetyloxy-4-methylsulfanylbutanoic acid
SYSTEMATIC NAME: 2-acetyloxy-4-methylsulfanyl-butanoic acid
MOLECULAR FORMULA: C7H12O4S
MOLECULAR WEIGHT: 192.23278
SMILES: CC(=O)OC(CCSC)C(=O)O
Structure:

CAS RN: 160893-98-1
CAS Name: 2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-cyclohexenecarboxylic acid
OPENEYE Name: 2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]cyclohexene-1-carboxylic acid
IUPAC Name: 2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]cyclohexene-1-carboxylic acid
SYSTEMATIC NAME: 2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]cyclohexene-1-carboxylic acid
MOLECULAR FORMULA: C17H19N3O3S
MOLECULAR WEIGHT: 345.41606
SMILES: CCOC1=CC=CC=C1C2=NN=C(S2)NC3=C(CCCC3)C(=O)O
Structure:

CAS RN: 160893-97-0
CAS Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]-1-cyclohexenecarboxylic acid
OPENEYE Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
IUPAC Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
SYSTEMATIC NAME: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
MOLECULAR FORMULA: C15H15N3O2S
MOLECULAR WEIGHT: 301.3635
SMILES: C1CCC(=C(C1)C(=O)O)NC2=NN=C(S2)C3=CC=CC=C3
Structure:

CAS RN: 160893-96-9
CAS Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-cyclohexenecarboxylic acid
OPENEYE Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
IUPAC Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
SYSTEMATIC NAME: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
MOLECULAR FORMULA: C11H15N3O2S
MOLECULAR WEIGHT: 253.3207
SMILES: CCC1=NN=C(S1)NC2=C(CCCC2)C(=O)O
Structure:

CAS RN: 160893-95-8
CAS Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-cyclohexenecarboxylic acid
OPENEYE Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
IUPAC Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
SYSTEMATIC NAME: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
MOLECULAR FORMULA: C10H13N3O2S
MOLECULAR WEIGHT: 239.29412
SMILES: CC1=NN=C(S1)NC2=C(CCCC2)C(=O)O
Structure:

CAS RN: 160893-94-7
CAS Name: 2-(2-ethoxyphenyl)-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
OPENEYE Name: 2-(2-ethoxyphenyl)-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
IUPAC Name: 2-(2-ethoxyphenyl)-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
SYSTEMATIC NAME: 2-(2-ethoxyphenyl)-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
MOLECULAR FORMULA: C17H17N3OS2
MOLECULAR WEIGHT: 343.46638
SMILES: CCOC1=CC=CC=C1C2=NN3C(=S)C4=C(CCCC4)N=C3S2
Structure:

CAS RN: 160893-93-6
CAS Name: 2-phenyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
OPENEYE Name: 2-phenyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
IUPAC Name: 2-phenyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
SYSTEMATIC NAME: 2-phenyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
MOLECULAR FORMULA: C15H13N3S2
MOLECULAR WEIGHT: 299.41382
SMILES: C1CCC2=C(C1)C(=S)N3C(=N2)SC(=N3)C4=CC=CC=C4
Structure:

CAS RN: 160893-92-5
CAS Name: 2-ethyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
OPENEYE Name: 2-ethyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
IUPAC Name: 2-ethyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
SYSTEMATIC NAME: 2-ethyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
MOLECULAR FORMULA: C11H13N3S2
MOLECULAR WEIGHT: 251.37102
SMILES: CCC1=NN2C(=S)C3=C(CCCC3)N=C2S1
Structure:

CAS RN: 160893-91-4
CAS Name: 2-methyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
OPENEYE Name: 2-methyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
IUPAC Name: 2-methyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
SYSTEMATIC NAME: 2-methyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazoline-5-thione
MOLECULAR FORMULA: C10H11N3S2
MOLECULAR WEIGHT: 237.34444
SMILES: CC1=NN2C(=S)C3=C(CCCC3)N=C2S1
Structure:

CAS RN: 160893-86-7
CAS Name: 5-amino-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-7-one
OPENEYE Name: 5-amino-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-7-one
IUPAC Name: 5-amino-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-7-one
SYSTEMATIC NAME: 5-azanyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-7-one
MOLECULAR FORMULA: C11H8N4O2
MOLECULAR WEIGHT: 228.20682
SMILES: C1=CC=C(C=C1)C2=NN3C(=CC(=O)N=C3O2)N
Structure:

CAS RN: 160893-85-6
CAS Name: 2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
OPENEYE Name: 2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
IUPAC Name: 2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H9N3O2S
MOLECULAR WEIGHT: 247.27306
SMILES: COC1=CC2=C(C=C1)N=C(S2)NC(=O)CC#N
Structure:

CAS RN: 160893-84-5
CAS Name: 2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide
OPENEYE Name: 2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide
IUPAC Name: 2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H9N3OS
MOLECULAR WEIGHT: 231.27366
SMILES: CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC#N
Structure:

CAS RN: 160893-83-4
CAS Name: 2-cyano-N-[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]acetamide
OPENEYE Name: 2-cyano-N-[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]acetamide
IUPAC Name: 2-cyano-N-[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]acetamide
SYSTEMATIC NAME: 2-cyano-N-[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]ethanamide
MOLECULAR FORMULA: C13H12N4O3
MOLECULAR WEIGHT: 272.25938
SMILES: CCOC1=CC=CC=C1C2=NN=C(O2)NC(=O)CC#N
Structure:

CAS RN: 160857-65-8
CAS Name: N-[4-[[4-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
OPENEYE Name: N-[4-[[4-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
IUPAC Name: N-[4-[[4-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[4-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]ethanamide
MOLECULAR FORMULA: C21H20N6O6S
MOLECULAR WEIGHT: 484.4851
SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN2CCC(=CC2)C3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]
Structure:

CAS RN: 160857-64-7
CAS Name: N-[4-[[4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
OPENEYE Name: N-[4-[[4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
IUPAC Name: N-[4-[[4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]ethanamide
MOLECULAR FORMULA: C21H20ClN5O4S
MOLECULAR WEIGHT: 473.9326
SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN2CCC(=CC2)C3=NN=C(O3)C4=CC=C(C=C4)Cl
Structure:

CAS RN: 160857-63-6
CAS Name: N-[4-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
OPENEYE Name: N-[4-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
IUPAC Name: N-[4-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]sulfamoyl]phenyl]ethanamide
MOLECULAR FORMULA: C21H21N5O4S
MOLECULAR WEIGHT: 439.48754
SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN2CCC(=CC2)C3=NN=C(O3)C4=CC=CC=C4
Structure:

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