2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide

Systemtic Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide Openeye Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[3-cyano-6-(4-methylphenyl)-2-pyridinyl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-cyclohexylacetamide Traditional Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]thio]-N-cyclohexyl-acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C21H23N3OS/c1-15-7-9-16(10-8-15)19-12-11-17(13-22)21(24-19)26-14-20(25)23-18-5-3-2-4-6-18/h7-12,18H,2-6,14H2,1H3,(H,23,25)