2-methyl-4-[(4-methylphenyl)sulfonylamino]thiophene-3-carboxylic acid

Systemtic Name: 2-methyl-4-[(4-methylphenyl)sulfonylamino]thiophene-3-carboxylic acid Openeye Name: 2-methyl-4-(p-tolylsulfonylamino)thiophene-3-carboxylic acid CAS Name: 2-methyl-4-[(4-methylphenyl)sulfonylamino]-3-thiophenecarboxylic acid IUPAC Name: 2-methyl-4-[(4-methylphenyl)sulfonylamino]thiophene-3-carboxylic acid Traditional Name: 2-methyl-4-(tosylamino)-3-thenoic acid Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CSC(=C2C(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CSC(=C2C(=O)O)C

InChI

InChI=1S/C13H13NO4S2/c1-8-3-5-10(6-4-8)20(17,18)14-11-7-19-9(2)12(11)13(15)16/h3-7,14H,1-2H3,(H,15,16)