Tuesday, January 24, 2012

http://ChemLookup.com Compounds




CAS RN: 178879-99-7
CAS Name: 1-methyl-3-[methyl(3-pyridinyl)sulfamoyl]-4-pyrazolecarboxylic acid
OPENEYE Name: 1-methyl-3-[methyl(3-pyridyl)sulfamoyl]pyrazole-4-carboxylic acid
IUPAC Name: 1-methyl-3-[methyl(pyridin-3-yl)sulfamoyl]pyrazole-4-carboxylic acid
SYSTEMATIC NAME: 1-methyl-3-[methyl(pyridin-3-yl)sulfamoyl]pyrazole-4-carboxylic acid
MOLECULAR FORMULA: C11H12N4O4S
MOLECULAR WEIGHT: 296.30238
SMILES: CN1C=C(C(=N1)S(=O)(=O)N(C)C2=CN=CC=C2)C(=O)O
Structure:

CAS RN: 178879-98-6
CAS Name: 1-methyl-3-[methyl(3-pyridinyl)sulfamoyl]-4-pyrazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-methyl-3-[methyl(3-pyridyl)sulfamoyl]pyrazole-4-carboxylate
IUPAC Name: ethyl 1-methyl-3-[methyl(pyridin-3-yl)sulfamoyl]pyrazole-4-carboxylate
SYSTEMATIC NAME: ethyl 1-methyl-3-[methyl(pyridin-3-yl)sulfamoyl]pyrazole-4-carboxylate
MOLECULAR FORMULA: C13H16N4O4S
MOLECULAR WEIGHT: 324.35554
SMILES: CCOC(=O)C1=CN(N=C1S(=O)(=O)N(C)C2=CN=CC=C2)C
Structure:

CAS RN: 178879-97-5
CAS Name: 1-methyl-3-(3-pyridinylsulfamoyl)-4-pyrazolecarboxylic acid
OPENEYE Name: 1-methyl-3-(3-pyridylsulfamoyl)pyrazole-4-carboxylic acid
IUPAC Name: 1-methyl-3-(pyridin-3-ylsulfamoyl)pyrazole-4-carboxylic acid
SYSTEMATIC NAME: 1-methyl-3-(pyridin-3-ylsulfamoyl)pyrazole-4-carboxylic acid
MOLECULAR FORMULA: C10H10N4O4S
MOLECULAR WEIGHT: 282.2758
SMILES: CN1C=C(C(=N1)S(=O)(=O)NC2=CN=CC=C2)C(=O)O
Structure:

CAS RN: 178879-96-4
CAS Name: 1-methyl-3-(3-pyridinylsulfamoyl)-4-pyrazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-methyl-3-(3-pyridylsulfamoyl)pyrazole-4-carboxylate
IUPAC Name: ethyl 1-methyl-3-(pyridin-3-ylsulfamoyl)pyrazole-4-carboxylate
SYSTEMATIC NAME: ethyl 1-methyl-3-(pyridin-3-ylsulfamoyl)pyrazole-4-carboxylate
MOLECULAR FORMULA: C12H14N4O4S
MOLECULAR WEIGHT: 310.32896
SMILES: CCOC(=O)C1=CN(N=C1S(=O)(=O)NC2=CN=CC=C2)C
Structure:

CAS RN: 178879-95-3
CAS Name: 1-methyl-3-sulfamoyl-4-pyrazolecarboxylic acid
OPENEYE Name: 1-methyl-3-sulfamoyl-pyrazole-4-carboxylic acid
IUPAC Name: 1-methyl-3-sulfamoylpyrazole-4-carboxylic acid
SYSTEMATIC NAME: 1-methyl-3-sulfamoyl-pyrazole-4-carboxylic acid
MOLECULAR FORMULA: C5H7N3O4S
MOLECULAR WEIGHT: 205.19178
SMILES: CN1C=C(C(=N1)S(=O)(=O)N)C(=O)O
Structure:

CAS RN: 178738-66-4
CAS Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(prop-2-enylamino)oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5S,6R)-2-(allylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(prop-2-enylamino)oxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(prop-2-enylamino)oxane-3,4,5-triol
MOLECULAR FORMULA: C9H17NO5
MOLECULAR WEIGHT: 219.23498
SMILES: C=CCN[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Structure:

CAS RN: 178563-31-0
CAS Name: (2R,3R,4S,5S,6R)-2-(dimethylamino)-6-(hydroxymethyl)oxane-3,4,5-triol hydrochloride
OPENEYE Name: (2R,3R,4S,5S,6R)-2-(dimethylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol hydrochloride
IUPAC Name: (2R,3R,4S,5S,6R)-2-(dimethylamino)-6-(hydroxymethyl)oxane-3,4,5-triol hydrochloride
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-(dimethylamino)-6-(hydroxymethyl)oxane-3,4,5-triol hydrochloride
MOLECULAR FORMULA: C8H18ClNO5
MOLECULAR WEIGHT: 243.68522
SMILES: CN(C)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O.Cl
Structure:

CAS RN: 178563-30-9
CAS Name: (2R,3R,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2R,3R,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2R,3R,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C16H27NO5
MOLECULAR WEIGHT: 313.38928
SMILES: C1C2CC3CC1CC(C2)C3N[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Structure:

CAS RN: 178563-29-6
CAS Name: (2S,3R,4S,5S,6R)-2-[[(2R,3S,4R,5S,6R)-6-(2-adamantylamino)-4,5-dihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5S,6R)-6-(2-adamantylamino)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5S,6R)-6-(2-adamantylamino)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5S,6R)-6-(2-adamantylamino)-2-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C22H37NO10
MOLECULAR WEIGHT: 475.52988
SMILES: C1C2CC3CC1CC(C2)C3N[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O
Structure:

CAS RN: 178563-28-5
CAS Name: (2R,3S,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2R,3S,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2R,3S,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3S,4S,5S,6R)-2-(2-adamantylamino)-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C16H27NO5
MOLECULAR WEIGHT: 313.38928
SMILES: C1C2CC3CC1CC(C2)C3N[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Structure:

CAS RN: 178452-85-2
CAS Name: N,N-diethyl-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b]thiazol-2-yl)acetamide
OPENEYE Name: N,N-diethyl-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b]thiazol-2-yl)acetamide
IUPAC Name: N,N-diethyl-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl)acetamide
SYSTEMATIC NAME: N,N-diethyl-2-[4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl]ethanamide
MOLECULAR FORMULA: C14H19N5O3S
MOLECULAR WEIGHT: 337.39736
SMILES: CCN(CC)C(=O)CN1C(=O)C2=C(N=C3N2CCS3)N(C1=O)C
Structure:

CAS RN: 178452-84-1
CAS Name: N,N-bis(2-hydroxyethyl)-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b]thiazol-2-yl)acetamide
OPENEYE Name: N,N-bis(2-hydroxyethyl)-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b]thiazol-2-yl)acetamide
IUPAC Name: N,N-bis(2-hydroxyethyl)-2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl)acetamide
SYSTEMATIC NAME: N,N-bis(2-hydroxyethyl)-2-[4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl]ethanamide
MOLECULAR FORMULA: C14H19N5O5S
MOLECULAR WEIGHT: 369.39616
SMILES: CN1C2=C(C(=O)N(C1=O)CC(=O)N(CCO)CCO)N3CCSC3=N2
Structure:

CAS RN: 178452-83-0
CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]-4-methyl-7,8-dihydropurino[8,7-b]thiazole-1,3-dione
OPENEYE Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-4-methyl-7,8-dihydropurino[8,7-b]thiazole-1,3-dione
IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]-4-methyl-7,8-dihydropurino[8,7-b][1,3]thiazole-1,3-dione
SYSTEMATIC NAME: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-4-methyl-7,8-dihydropurino[8,7-b][1,3]thiazole-1,3-dione
MOLECULAR FORMULA: C16H21N5O3S
MOLECULAR WEIGHT: 363.43464
SMILES: CN1C2=C(C(=O)N(C1=O)CC(=O)N3CCCCCC3)N4CCSC4=N2
Structure:

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