[2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 1-benzofuran-2-carboxylate Openeye Name: [2-(2-benzylsulfanylethylamino)-2-oxo-ethyl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [2-oxo-2-[2-(phenylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-(2-benzylsulfanylethylamino)-2-oxoethyl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [2-[2-(benzylthio)ethylamino]-2-keto-ethyl] ester Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)COC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)COC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C20H19NO4S/c22-19(21-10-11-26-14-15-6-2-1-3-7-15)13-24-20(23)18-12-16-8-4-5-9-17(16)25-18/h1-9,12H,10-11,13-14H2,(H,21,22)