3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1-oxidanylidene-N-(pyridin-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1-oxidanylidene-N-(pyridin-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1-oxo-N-(2-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1-oxo-N-(2-pyridinylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1-oxo-N-(pyridin-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1-keto-2-methyl-N-(2-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C25H19F6N3O2 MolecularWeight: 507.427679

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CC=CC=N3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CC=CC=N3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H19F6N3O2/c1-34-21(14-10-15(24(26,27)28)12-16(11-14)25(29,30)31)20(18-7-2-3-8-19(18)23(34)36)22(35)33-13-17-6-4-5-9-32-17/h2-12,20-21H,13H2,1H3,(H,33,35)