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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CN=CC=C3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC3=CN=CC=C3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

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