3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-[[3-(methylthio)phenyl]sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 3-[[3-(methylthio)phenyl]sulfamoyl]-2-thenoic acid Formula: C12H11NO4S3 MolecularWeight: 329.41504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)O

Isomeric SMILES

CSC1=CC=CC(=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)O

InChI

InChI=1S/C12H11NO4S3/c1-18-9-4-2-3-8(7-9)13-20(16,17)10-5-6-19-11(10)12(14)15/h2-7,13H,1H3,(H,14,15)