[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-ethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-ethylbenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-2-15-8-10-16(11-9-15)19(22)23-14-18(21)20-12-13-24-17-6-4-3-5-7-17/h3-11H,2,12-14H2,1H3,(H,20,21)