[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-acetamidobenzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-acetamidobenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O4S/c1-14(22)21-16-7-5-6-15(12-16)19(24)25-13-18(23)20-10-11-26-17-8-3-2-4-9-17/h2-9,12H,10-11,13H2,1H3,(H,20,23)(H,21,22)