2-(4-chlorophenyl)sulfanylethyl 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C19H19ClN2O3S MolecularWeight: 390.88376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)OCCSC2=CC=C(C=C2)Cl)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)OCCSC2=CC=C(C=C2)Cl)C)C#N

InChI

InChI=1S/C19H19ClN2O3S/c1-12-16(13(2)22-19(24)17(12)11-21)7-8-18(23)25-9-10-26-15-5-3-14(20)4-6-15/h3-6H,7-10H2,1-2H3,(H,22,24)