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

Systemtic Name: 5-(5-cyanothiophen-3-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Openeye Name: 5-(5-cyano-3-thienyl)-3-(o-tolylsulfonylamino)thiophene-2-carboxylic acid CAS Name: 5-(5-cyano-3-thiophenyl)-3-[(2-methylphenyl)sulfonylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-(5-cyanothiophen-3-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Traditional Name: 5-(5-cyano-3-thienyl)-3-(o-tolylsulfonylamino)-2-thenoic acid Formula: C17H12N2O4S3 MolecularWeight: 404.48318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2O4S3/c1-10-4-2-3-5-15(10)26(22,23)19-13-7-14(25-16(13)17(20)21)11-6-12(8-18)24-9-11/h2-7,9,19H,1H3,(H,20,21)