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

Systemtic Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(3-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxo-butyl]-6-(3-methoxyphenyl)pyridazin-3-one CAS Name: 2-[4-[4-(2-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-(3-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxobutyl]-6-(3-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[4-[4-(2-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=CC=C4F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

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