3-methyl-5-[(4-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[(4-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[(4-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[4-(methylthio)phenyl]sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[(4-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[[4-(methylthio)phenyl]sulfamoyl]-2-thenoic acid Formula: C13H13NO4S3 MolecularWeight: 343.44162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)NC2=CC=C(C=C2)SC)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)NC2=CC=C(C=C2)SC)C(=O)O

InChI

InChI=1S/C13H13NO4S3/c1-8-7-11(20-12(8)13(15)16)21(17,18)14-9-3-5-10(19-2)6-4-9/h3-7,14H,1-2H3,(H,15,16)