1-[4-[6-[(4-methylphenyl)amino]pyridazin-3-yl]piperazin-1-yl]-2-phenoxy-propan-1-one

Systemtic Name: 1-[4-[6-[(4-methylphenyl)amino]pyridazin-3-yl]piperazin-1-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-2-phenoxy-propan-1-one CAS Name: 1-[4-[6-(4-methylanilino)-3-pyridazinyl]-1-piperazinyl]-2-phenoxy-1-propanone IUPAC Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-2-phenoxypropan-1-one Traditional Name: 2-phenoxy-1-[4-[6-(p-toluidino)pyridazin-3-yl]piperazino]propan-1-one Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O2/c1-18-8-10-20(11-9-18)25-22-12-13-23(27-26-22)28-14-16-29(17-15-28)24(30)19(2)31-21-6-4-3-5-7-21/h3-13,19H,14-17H2,1-2H3,(H,25,26)