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

Systemtic Name: 2-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-butyl]-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 2-[4-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-(4-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl]-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[4-[4-(4-fluorophenyl)piperazino]-4-keto-butyl]-6-(4-methoxyphenyl)pyridazin-3-one Formula: C25H27FN4O3 MolecularWeight: 450.505283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN4O3/c1-33-22-10-4-19(5-11-22)23-12-13-25(32)30(27-23)14-2-3-24(31)29-17-15-28(16-18-29)21-8-6-20(26)7-9-21/h4-13H,2-3,14-18H2,1H3