2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]acetamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)NCCC2=CC=C(C=C2)OC)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)NCCC2=CC=C(C=C2)OC)C#N)C(=O)C

InChI

InChI=1S/C20H21N3O3S/c1-13-18(14(2)24)10-16(11-21)20(23-13)27-12-19(25)22-9-8-15-4-6-17(26-3)7-5-15/h4-7,10H,8-9,12H2,1-3H3,(H,22,25)