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

Systemtic Name: 1-[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-[6-(1-azepanyl)-3-pyridazinyl]-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: 1-[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazino]-4-phenyl-butan-1-one Formula: C24H33N5O MolecularWeight: 407.55172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H33N5O/c30-24(12-8-11-21-9-4-3-5-10-21)29-19-17-28(18-20-29)23-14-13-22(25-26-23)27-15-6-1-2-7-16-27/h3-5,9-10,13-14H,1-2,6-8,11-12,15-20H2