[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(4-chlorophenyl)thio]-3-pyridinecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(4-chlorophenyl)thio]nicotinic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C18H18ClN3O4S MolecularWeight: 407.87122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-2-9-21-18(25)22-15(23)11-26-17(24)14-4-3-10-20-16(14)27-13-7-5-12(19)6-8-13/h3-8,10H,2,9,11H2,1H3,(H2,21,22,23,25)