[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(methylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(methylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 3-(methylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(methylthio)methyl]-2-benzofurancarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 3-(methylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(methylthio)methyl]coumarilic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CSCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H19NO4S/c1-26-13-16-15-9-5-6-10-17(15)25-19(16)20(23)24-12-18(22)21-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,21,22)