5-(3-cyanophenyl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-(3-cyanophenyl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Openeye Name: 5-(3-cyanophenyl)-3-(o-tolylsulfonylamino)thiophene-2-carboxylic acid CAS Name: 5-(3-cyanophenyl)-3-[(2-methylphenyl)sulfonylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-(3-cyanophenyl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Traditional Name: 5-(3-cyanophenyl)-3-(o-tolylsulfonylamino)-2-thenoic acid Formula: C19H14N2O4S2 MolecularWeight: 398.45546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC(=C3)C#N)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C19H14N2O4S2/c1-12-5-2-3-8-17(12)27(24,25)21-15-10-16(26-18(15)19(22)23)14-7-4-6-13(9-14)11-20/h2-10,21H,1H3,(H,22,23)