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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27FN4O3/c1-33-22-5-2-4-19(18-22)23-11-12-25(32)30(27-23)13-3-6-24(31)29-16-14-28(15-17-29)21-9-7-20(26)8-10-21/h2,4-5,7-12,18H,3,6,13-17H2,1H3