(4S)-4-(3-chlorophenyl)-5-cyano-3-ethanoyl-2-methyl-3,4-dihydropyridine-6-thiolate

Systemtic Name: (4S)-4-(3-chlorophenyl)-5-cyano-3-ethanoyl-2-methyl-3,4-dihydropyridine-6-thiolate Openeye Name: (4S)-3-acetyl-4-(3-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridine-6-thiolate CAS Name: (4S)-3-acetyl-4-(3-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridine-6-thiolate IUPAC Name: (4S)-3-acetyl-4-(3-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridine-6-thiolate Traditional Name: (4S)-3-acetyl-4-(3-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridine-6-thiolate Formula: C15H12ClN2OS- MolecularWeight: 303.78658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)C)C2=CC(=CC=C2)Cl)C#N)[S-]

Isomeric SMILES

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

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/h3-6,13-14,20H,1-2H3/p-1/t13?,14-/m0/s1