[2-oxidanylidene-2-(phenethylamino)ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 4-methylsulfanylbenzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2

InChI

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