(2-chlorophenyl) 2-(1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)sulfanylpyridine-3-carboxylate

Systemtic Name: (2-chlorophenyl) 2-(1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)sulfanylpyridine-3-carboxylate Openeye Name: (2-chlorophenyl) 2-[1-(morpholine-4-carbonyl)propylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[[1-(4-morpholinyl)-1-oxobutan-2-yl]thio]-3-pyridinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2-(1-morpholin-4-yl-1-oxobutan-2-yl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[1-(morpholine-4-carbonyl)propylthio]nicotinic acid (2-chlorophenyl) ester Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCOCC1)SC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

Isomeric SMILES

CCC(C(=O)N1CCOCC1)SC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN2O4S/c1-2-17(19(24)23-10-12-26-13-11-23)28-18-14(6-5-9-22-18)20(25)27-16-8-4-3-7-15(16)21/h3-9,17H,2,10-13H2,1H3