[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,4-dimethylbenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)C

InChI

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