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

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-1-[(2,5-dimethylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-1-[(2,5-dimethylphenyl)methyl]-6-oxo-pyridine-3-carboxamide CAS Name: N-(5-chloro-2-cyanophenyl)-1-[(2,5-dimethylphenyl)methyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-1-[(2,5-dimethylphenyl)methyl]-6-oxopyridine-3-carboxamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-1-(2,5-dimethylbenzyl)-6-keto-nicotinamide Formula: C22H18ClN3O2 MolecularWeight: 391.85022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN3O2/c1-14-3-4-15(2)18(9-14)13-26-12-17(6-8-21(26)27)22(28)25-20-10-19(23)7-5-16(20)11-24/h3-10,12H,13H2,1-2H3,(H,25,28)