3-[(3-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-[(3-methylsulfonylbenzoyl)amino]thiophene-2-carboxylic acid CAS Name: 3-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-methylsulfonylbenzoyl)amino]thiophene-2-carboxylic acid Traditional Name: 3-[(3-mesylbenzoyl)amino]-2-thenoic acid Formula: C13H11NO5S2 MolecularWeight: 325.36014

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)O

InChI

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