[4-(6-pyridin-4-ylpyridazin-3-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(6-pyridin-4-ylpyridazin-3-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Openeye Name: [4-[6-(4-pyridyl)pyridazin-3-yl]piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone CAS Name: [4-(6-pyridin-4-yl-3-pyridazinyl)-1-piperazinyl]-[3-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(6-pyridin-4-ylpyridazin-3-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Traditional Name: [4-[6-(4-pyridyl)pyridazin-3-yl]piperazino]-[3-(trifluoromethyl)phenyl]methanone Formula: C21H18F3N5O MolecularWeight: 413.39573

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=NC=C3)C(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=NC=C3)C(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N5O/c22-21(23,24)17-3-1-2-16(14-17)20(30)29-12-10-28(11-13-29)19-5-4-18(26-27-19)15-6-8-25-9-7-15/h1-9,14H,10-13H2