5-[[2-(phenylmethylsulfanyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[2-(phenylmethylsulfanyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[(2-benzylsulfanylphenyl)sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[2-(phenylmethylthio)phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[(2-benzylsulfanylphenyl)sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[2-(benzylthio)phenyl]sulfamoyl]-3-thenoic acid Formula: C18H15NO4S3 MolecularWeight: 405.511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=C2NS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=C2NS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C18H15NO4S3/c20-18(21)14-10-17(25-12-14)26(22,23)19-15-8-4-5-9-16(15)24-11-13-6-2-1-3-7-13/h1-10,12,19H,11H2,(H,20,21)