3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-6-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C22H18F3N3O2 MolecularWeight: 413.39243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H18F3N3O2/c1-14-11-19(29)20(21(30)27-10-9-15-5-2-3-6-16(15)13-27)26-28(14)18-8-4-7-17(12-18)22(23,24)25/h2-8,11-12H,9-10,13H2,1H3