[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] quinoline-8-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] quinoline-8-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C20H18N2O3S MolecularWeight: 366.43352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C20H18N2O3S/c23-18(21-12-13-26-16-8-2-1-3-9-16)14-25-20(24)17-10-4-6-15-7-5-11-22-19(15)17/h1-11H,12-14H2,(H,21,23)