methyl 2-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]thiophene-3-carboxylate Openeye Name: methyl 2-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]thiophene-3-carboxylate CAS Name: 2-[[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]thiophene-3-carboxylate Traditional Name: 2-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]sulfamoyl]thiophene-3-carboxylic acid methyl ester Formula: C21H21N5O4S2 MolecularWeight: 471.55254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)NS(=O)(=O)C4=C(C=CS4)C(=O)OC

Isomeric SMILES

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)NS(=O)(=O)C4=C(C=CS4)C(=O)OC

InChI

InChI=1S/C21H21N5O4S2/c1-25-13-23-10-17(25)12-26-11-16(8-15-7-14(9-22)3-4-19(15)26)24-32(28,29)21-18(5-6-31-21)20(27)30-2/h3-7,10,13,16,24H,8,11-12H2,1-2H3