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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)C)C2=CC=CC=C2Cl)C#N)S

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)C)C2=CC=CC=C2Cl)C#N)S

InChI

InChI=1S/C15H13ClN2OS/c1-8-13(9(2)19)14(11(7-17)15(20)18-8)10-5-3-4-6-12(10)16/h3-6,13-14,20H,1-2H3/t13?,14-/m0/s1