2-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-fluorophenyl)pyridazin-3-one

Systemtic Name: 2-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-fluorophenyl)pyridazin-3-one Openeye Name: 2-[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butyl]-6-(4-fluorophenyl)pyridazin-3-one CAS Name: 2-[4-[4-(diphenylmethyl)-1-piperazinyl]-4-oxobutyl]-6-(4-fluorophenyl)-3-pyridazinone IUPAC Name: 2-[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutyl]-6-(4-fluorophenyl)pyridazin-3-one Traditional Name: 2-[4-(4-benzhydrylpiperazino)-4-keto-butyl]-6-(4-fluorophenyl)pyridazin-3-one Formula: C31H31FN4O2 MolecularWeight: 510.601843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCN4C(=O)C=CC(=N4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCN4C(=O)C=CC(=N4)C5=CC=C(C=C5)F

InChI

InChI=1S/C31H31FN4O2/c32-27-15-13-24(14-16-27)28-17-18-30(38)36(33-28)19-7-12-29(37)34-20-22-35(23-21-34)31(25-8-3-1-4-9-25)26-10-5-2-6-11-26/h1-6,8-11,13-18,31H,7,12,19-23H2