4-chloranyl-2-phenyl-5-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazino]pyridazin-3-one Formula: C22H18ClF3N4O2 MolecularWeight: 462.85213

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H18ClF3N4O2/c23-19-18(14-27-30(21(19)32)17-4-2-1-3-5-17)28-10-12-29(13-11-28)20(31)15-6-8-16(9-7-15)22(24,25)26/h1-9,14H,10-13H2