5-[[2-[(4-methylphenyl)methylcarbamoyl]phenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[2-[(4-methylphenyl)methylcarbamoyl]phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[2-(p-tolylmethylcarbamoyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[2-[[(4-methylphenyl)methylamino]-oxomethyl]phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[2-[(4-methylphenyl)methylcarbamoyl]phenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[2-[(4-methylbenzyl)carbamoyl]phenyl]sulfamoyl]-3-thenoic acid Formula: C20H18N2O5S2 MolecularWeight: 430.49732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C20H18N2O5S2/c1-13-6-8-14(9-7-13)11-21-19(23)16-4-2-3-5-17(16)22-29(26,27)18-10-15(12-28-18)20(24)25/h2-10,12,22H,11H2,1H3,(H,21,23)(H,24,25)