[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2,4-dimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2,4-dimethoxybenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C19H21NO5S MolecularWeight: 375.43874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C19H21NO5S/c1-23-14-8-9-16(17(12-14)24-2)19(22)25-13-18(21)20-10-11-26-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3,(H,20,21)