3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(5-methylpyridin-2-yl)propanamide

Systemtic Name: 3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(5-methylpyridin-2-yl)propanamide Openeye Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]sulfanyl]-N-(5-methyl-2-pyridyl)propanamide CAS Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]thio]-N-(5-methyl-2-pyridinyl)propanamide IUPAC Name: 3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(5-methylpyridin-2-yl)propanamide Traditional Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]thio]-N-(5-methyl-2-pyridyl)propionamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC(=O)CCSC2=C(C=CC(=N2)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=CN=C(C=C1)NC(=O)CCSC2=C(C=CC(=N2)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C22H20N4O2S/c1-15-3-10-20(24-14-15)26-21(27)11-12-29-22-17(13-23)6-9-19(25-22)16-4-7-18(28-2)8-5-16/h3-10,14H,11-12H2,1-2H3,(H,24,26,27)