N-[2-(3-chlorophenyl)ethyl]-2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]thio]acetamide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H20ClN3O2S/c1-29-20-7-3-5-17(13-20)21-9-8-18(14-25)23(27-21)30-15-22(28)26-11-10-16-4-2-6-19(24)12-16/h2-9,12-13H,10-11,15H2,1H3,(H,26,28)