5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[(4-isobutylphenyl)-(2-thienyl)methyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[(4-isobutylphenyl)-(2-thienyl)methyl]sulfamoyl]-3-thenoic acid Formula: C20H21NO4S3 MolecularWeight: 435.58004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C20H21NO4S3/c1-13(2)10-14-5-7-15(8-6-14)19(17-4-3-9-26-17)21-28(24,25)18-11-16(12-27-18)20(22)23/h3-9,11-13,19,21H,10H2,1-2H3,(H,22,23)