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

Systemtic Name: 4-methyl-6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one Openeye Name: 4-methyl-6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one CAS Name: 4-methyl-6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]butyl]-3-pyridazinone IUPAC Name: 4-methyl-6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]pyridazin-3-one Traditional Name: 4-methyl-6-phenyl-2-[4-[4-[3-(trifluoromethyl)phenyl]piperazino]butyl]pyridazin-3-one Formula: C26H29F3N4O MolecularWeight: 470.52987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN(C1=O)CCCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN(C1=O)CCCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C26H29F3N4O/c1-20-18-24(21-8-3-2-4-9-21)30-33(25(20)34)13-6-5-12-31-14-16-32(17-15-31)23-11-7-10-22(19-23)26(27,28)29/h2-4,7-11,18-19H,5-6,12-17H2,1H3