N-(5-chloranyl-2-cyano-phenyl)-1-[(4-methylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-1-[(4-methylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-6-oxo-1-(p-tolylmethyl)pyridine-3-carboxamide CAS Name: N-(5-chloro-2-cyanophenyl)-1-[(4-methylphenyl)methyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-1-[(4-methylphenyl)methyl]-6-oxopyridine-3-carboxamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-6-keto-1-(4-methylbenzyl)nicotinamide Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(=O)NC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(=O)NC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C21H16ClN3O2/c1-14-2-4-15(5-3-14)12-25-13-17(7-9-20(25)26)21(27)24-19-10-18(22)8-6-16(19)11-23/h2-10,13H,12H2,1H3,(H,24,27)