1-[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: 1-[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazino]-4-phenyl-butan-1-one Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c1-31-22-11-6-10-21(19-22)23-13-14-24(27-26-23)28-15-17-29(18-16-28)25(30)12-5-9-20-7-3-2-4-8-20/h2-4,6-8,10-11,13-14,19H,5,9,12,15-18H2,1H3