5-[4-[(1-methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenyl-4-[1-(phenylmethyl)piperidin-4-yl]oxy-pyridazin-3-one

Systemtic Name: 5-[4-[(1-methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenyl-4-[1-(phenylmethyl)piperidin-4-yl]oxy-pyridazin-3-one Openeye Name: 4-[(1-benzyl-4-piperidyl)oxy]-5-[4-[(1-methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(1-methyl-2-pyrrolyl)methyl]-1-piperazinyl]-2-phenyl-4-[[1-(phenylmethyl)-4-piperidinyl]oxy]-3-pyridazinone IUPAC Name: 4-(1-benzylpiperidin-4-yl)oxy-5-[4-[(1-methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-[(1-benzyl-4-piperidyl)oxy]-5-[4-[(1-methylpyrrol-2-yl)methyl]piperazino]-2-phenyl-pyridazin-3-one Formula: C32H38N6O2 MolecularWeight: 538.68312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OC5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

CN1C=CC=C1CN2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OC5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C32H38N6O2/c1-34-16-8-13-28(34)25-36-19-21-37(22-20-36)30-23-33-38(27-11-6-3-7-12-27)32(39)31(30)40-29-14-17-35(18-15-29)24-26-9-4-2-5-10-26/h2-13,16,23,29H,14-15,17-22,24-25H2,1H3