4-methyl-3-(thiophen-2-ylmethylsulfamoyl)benzoic acid

Systemtic Name: 4-methyl-3-(thiophen-2-ylmethylsulfamoyl)benzoic acid Openeye Name: 4-methyl-3-(2-thienylmethylsulfamoyl)benzoic acid CAS Name: 4-methyl-3-(thiophen-2-ylmethylsulfamoyl)benzoic acid IUPAC Name: 4-methyl-3-(thiophen-2-ylmethylsulfamoyl)benzoic acid Traditional Name: 4-methyl-3-(2-thenylsulfamoyl)benzoic acid Formula: C13H13NO4S2 MolecularWeight: 311.37662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCC2=CC=CS2

InChI

InChI=1S/C13H13NO4S2/c1-9-4-5-10(13(15)16)7-12(9)20(17,18)14-8-11-3-2-6-19-11/h2-7,14H,8H2,1H3,(H,15,16)