6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one

Systemtic Name: 6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Traditional Name: 6-phenyl-2-[2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazino]ethyl]pyridazin-3-one Formula: C23H23F3N4O3S MolecularWeight: 492.51393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C23H23F3N4O3S/c24-23(25,26)19-8-4-5-9-21(19)34(32,33)29-15-12-28(13-16-29)14-17-30-22(31)11-10-20(27-30)18-6-2-1-3-7-18/h1-11H,12-17H2