N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(2-methylphenyl)pyridine-4-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(2-methylphenyl)pyridine-4-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(o-tolyl)pyridine-4-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(2-methylphenyl)-4-pyridinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(2-methylphenyl)pyridine-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-3-(o-tolyl)isonicotinamide Formula: C22H16F6N2O MolecularWeight: 438.365659

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CN=C2)C(=O)NCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CN=C2)C(=O)NCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H16F6N2O/c1-13-4-2-3-5-17(13)19-12-29-7-6-18(19)20(31)30-11-14-8-15(21(23,24)25)10-16(9-14)22(26,27)28/h2-10,12H,11H2,1H3,(H,30,31)