[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate

Systemtic Name: [2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate Openeye Name: [2-(2-methylsulfonylanilino)-2-oxo-ethyl] 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid [2-(2-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfonylanilino)-2-oxoethyl] 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid [2-keto-2-(2-mesylanilino)ethyl] ester Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)CCC2=CC=CS2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)CCC2=CC=CS2

InChI

InChI=1S/C16H17NO5S2/c1-24(20,21)14-7-3-2-6-13(14)17-15(18)11-22-16(19)9-8-12-5-4-10-23-12/h2-7,10H,8-9,11H2,1H3,(H,17,18)