3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[oxo-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[3-(trifluoromethyl)benzyl]piperazine-1-carbonyl]-1H-pyridazin-6-one Formula: C17H17F3N4O2 MolecularWeight: 366.33769

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C17H17F3N4O2/c18-17(19,20)13-3-1-2-12(10-13)11-23-6-8-24(9-7-23)16(26)14-4-5-15(25)22-21-14/h1-5,10H,6-9,11H2,(H,22,25)