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

Systemtic Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[3-cyano-6-(4-methylphenyl)-2-pyridinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]thio]-N-phenethyl-acetamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H21N3OS/c1-17-7-9-19(10-8-17)21-12-11-20(15-24)23(26-21)28-16-22(27)25-14-13-18-5-3-2-4-6-18/h2-12H,13-14,16H2,1H3,(H,25,27)