[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 4-methylsulfanylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CS2

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C16H17NO3S2/c1-21-13-6-4-12(5-7-13)16(19)20-11-15(18)17-9-8-14-3-2-10-22-14/h2-7,10H,8-9,11H2,1H3,(H,17,18)