6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one

Systemtic Name: 6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one Openeye Name: 6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one CAS Name: 6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]butyl]-3-pyridazinone IUPAC Name: 6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one Traditional Name: 6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazino]butyl]pyridazin-3-one Formula: C25H27F3N4O MolecularWeight: 456.50329

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)C3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)C3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H27F3N4O/c26-25(27,28)21-9-6-10-22(19-21)31-17-15-30(16-18-31)13-4-5-14-32-24(33)12-11-23(29-32)20-7-2-1-3-8-20/h1-3,6-12,19H,4-5,13-18H2