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

Systemtic Name: 4-(3-chlorophenyl)-5-ethanoyl-6-methyl-2-sulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(3-chlorophenyl)-6-methyl-2-sulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(3-chlorophenyl)-2-mercapto-6-methyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(3-chlorophenyl)-6-methyl-2-sulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(3-chlorophenyl)-2-mercapto-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C15H13ClN2OS MolecularWeight: 304.79452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClN2OS/c1-8-13(9(2)19)14(12(7-17)15(20)18-8)10-4-3-5-11(16)6-10/h3-6,14,18,20H,1-2H3