(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C20H13NO3S2 MolecularWeight: 379.45212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C20H13NO3S2/c21-12-14-6-1-3-8-17(14)26-18-9-4-2-7-15(18)20(23)24-13-16(22)19-10-5-11-25-19/h1-11H,13H2