4-(4-chlorophenyl)-2-(cyanomethylsulfanyl)-5-ethanoyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-(cyanomethylsulfanyl)-5-ethanoyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(4-chlorophenyl)-2-(cyanomethylsulfanyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-chlorophenyl)-2-(cyanomethylthio)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-4-(4-chlorophenyl)-2-(cyanomethylsulfanyl)-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(4-chlorophenyl)-2-(cyanomethylthio)-6-methyl-nicotinonitrile Formula: C17H12ClN3OS MolecularWeight: 341.81468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClN3OS/c1-10-15(11(2)22)16(12-3-5-13(18)6-4-12)14(9-20)17(21-10)23-8-7-19/h3-6H,8H2,1-2H3