1-(4-methylphenyl)-4-[4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: 1-(4-methylphenyl)-4-[4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: 4-[4-(6-phenoxypyridazin-3-yl)piperazine-1-carbonyl]-1-(p-tolyl)pyrrolidin-2-one CAS Name: 1-(4-methylphenyl)-4-[oxo-[4-(6-phenoxy-3-pyridazinyl)-1-piperazinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-(4-methylphenyl)-4-[4-(6-phenoxypyridazin-3-yl)piperazine-1-carbonyl]pyrrolidin-2-one Traditional Name: 4-[4-(6-phenoxypyridazin-3-yl)piperazine-1-carbonyl]-1-(p-tolyl)-2-pyrrolidone Formula: C26H27N5O3 MolecularWeight: 457.52428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=NN=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=NN=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H27N5O3/c1-19-7-9-21(10-8-19)31-18-20(17-25(31)32)26(33)30-15-13-29(14-16-30)23-11-12-24(28-27-23)34-22-5-3-2-4-6-22/h2-12,20H,13-18H2,1H3