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

Systemtic Name: 1-[4-[6-[(4-methylphenyl)amino]pyridazin-3-yl]piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-[6-(4-methylanilino)-3-pyridazinyl]-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[6-(4-methylanilino)pyridazin-3-yl]piperazin-1-yl]-2-phenoxyethanone Traditional Name: 2-phenoxy-1-[4-[6-(p-toluidino)pyridazin-3-yl]piperazino]ethanone Formula: C23H25N5O2 MolecularWeight: 403.4769

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O2/c1-18-7-9-19(10-8-18)24-21-11-12-22(26-25-21)27-13-15-28(16-14-27)23(29)17-30-20-5-3-2-4-6-20/h2-12H,13-17H2,1H3,(H,24,25)