[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-methylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-methylbenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1C(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c1-14-7-5-6-10-16(14)18(21)22-13-17(20)19-11-12-23-15-8-3-2-4-9-15/h2-10H,11-13H2,1H3,(H,19,20)