5-[(4-bromophenyl)methyl-methyl-sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[(4-bromophenyl)methyl-methyl-sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[(4-bromophenyl)methyl-methyl-sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[(4-bromophenyl)methyl-methylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[(4-bromophenyl)methyl-methylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[(4-bromobenzyl)-methyl-sulfamoyl]-3-thenoic acid Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)S(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)S(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C13H12BrNO4S2/c1-15(7-9-2-4-11(14)5-3-9)21(18,19)12-6-10(8-20-12)13(16)17/h2-6,8H,7H2,1H3,(H,16,17)