2-[4-[1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[oxo-[1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolyl]methyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-[1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazino]-N-phenyl-acetamide Formula: C21H20F3N7O3 MolecularWeight: 475.42381

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N7O3/c22-21(23,24)19-15(12-25-31(19)16-6-7-17(32)28-27-16)20(34)30-10-8-29(9-11-30)13-18(33)26-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,26,33)(H,28,32)