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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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