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

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-6-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: N-(5-chloro-2-cyanophenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-6-keto-1-[3-(trifluoromethyl)benzyl]nicotinamide Formula: C21H13ClF3N3O2 MolecularWeight: 431.79503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClF3N3O2/c22-17-6-4-14(10-26)18(9-17)27-20(30)15-5-7-19(29)28(12-15)11-13-2-1-3-16(8-13)21(23,24)25/h1-9,12H,11H2,(H,27,30)