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

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[3-(trifluoromethyl)benzyl]piperazino]pyridazin-3-one Formula: C22H20ClF3N4O MolecularWeight: 448.86861

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H20ClF3N4O/c23-20-19(14-27-30(21(20)31)18-7-2-1-3-8-18)29-11-9-28(10-12-29)15-16-5-4-6-17(13-16)22(24,25)26/h1-8,13-14H,9-12,15H2