2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-homoveratryl-acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C21H25N3O3S/c1-13-14(2)17(11-22)21(24-15(13)3)28-12-20(25)23-9-8-16-6-7-18(26-4)19(10-16)27-5/h6-7,10H,8-9,12H2,1-5H3,(H,23,25)