4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-N-(o-tolyl)-6-thioxo-1H-pyridine-3-carboxamide CAS Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-N-(o-tolyl)-6-thioxo-1H-pyridine-3-carboxamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(NC(=S)C(=C2C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(NC(=S)C(=C2C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C21H16ClN3OS/c1-12-5-3-4-6-17(12)25-20(26)18-13(2)24-21(27)16(11-23)19(18)14-7-9-15(22)10-8-14/h3-10H,1-2H3,(H,24,27)(H,25,26)