5-[(4-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[(4-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-[(4-methylsulfonylbenzoyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-methylsulfonylbenzoyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[(4-mesylbenzoyl)amino]-2-thenoic acid Formula: C13H11NO5S2 MolecularWeight: 325.36014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C13H11NO5S2/c1-21(18,19)9-4-2-8(3-5-9)12(15)14-11-7-6-10(20-11)13(16)17/h2-7H,1H3,(H,14,15)(H,16,17)