2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-hexadecyl-ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-hexadecyl-ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-hexadecyl-acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-hexadecylacetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-hexadecylacetamide Traditional Name: N-cetyl-2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetamide Formula: C26H43N3OS MolecularWeight: 445.70412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)CSC1=C(C(=CC(=N1)C)C)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)CSC1=C(C(=CC(=N1)C)C)C#N

InChI

InChI=1S/C26H43N3OS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-25(30)21-31-26-24(20-27)22(2)19-23(3)29-26/h19H,4-18,21H2,1-3H3,(H,28,30)