4-(2-chlorophenyl)-5-ethanoyl-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-5-ethanoyl-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-(methylthio)-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-(methylthio)-1,4-dihydropyridine-3-carbonitrile Formula: C16H15ClN2OS MolecularWeight: 318.8211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SC)C#N)C2=CC=CC=C2Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SC)C#N)C2=CC=CC=C2Cl)C(=O)C

InChI

InChI=1S/C16H15ClN2OS/c1-9-14(10(2)20)15(11-6-4-5-7-13(11)17)12(8-18)16(19-9)21-3/h4-7,15,19H,1-3H3