(2-chlorophenyl) 2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: (2-chlorophenyl) 2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylpyridine-3-carboxylate Openeye Name: (2-chlorophenyl) 2-[2-oxo-2-(phenethylamino)ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-oxo-2-(phenethylamino)ethyl]thio]-3-pyridinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2-[2-oxo-2-(phenethylamino)ethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-(phenethylamino)ethyl]thio]nicotinic acid (2-chlorophenyl) ester Formula: C22H19ClN2O3S MolecularWeight: 426.91586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

InChI

InChI=1S/C22H19ClN2O3S/c23-18-10-4-5-11-19(18)28-22(27)17-9-6-13-25-21(17)29-15-20(26)24-14-12-16-7-2-1-3-8-16/h1-11,13H,12,14-15H2,(H,24,26)