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

Systemtic Name: 1-[4-[6-[(4-methylphenyl)amino]pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-[6-(4-methylanilino)-3-pyridazinyl]-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 4-phenyl-1-[4-[6-(p-toluidino)pyridazin-3-yl]piperazino]butan-1-one Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O/c1-20-10-12-22(13-11-20)26-23-14-15-24(28-27-23)29-16-18-30(19-17-29)25(31)9-5-8-21-6-3-2-4-7-21/h2-4,6-7,10-15H,5,8-9,16-19H2,1H3,(H,26,27)