4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(quinolin-4-ylmethyl)piperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(quinolin-4-ylmethyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(4-quinolylmethyl)piperazin-1-yl]pyridazin-3-one CAS Name: 4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(4-quinolinylmethyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(quinolin-4-ylmethyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 4-[2-(4-methoxyphenyl)ethoxy]-2-phenyl-5-[4-(4-quinolylmethyl)piperazino]pyridazin-3-one Formula: C33H33N5O3 MolecularWeight: 547.64682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCOC2=C(C=NN(C2=O)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=NC6=CC=CC=C56

Isomeric SMILES

COC1=CC=C(C=C1)CCOC2=C(C=NN(C2=O)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=NC6=CC=CC=C56

InChI

InChI=1S/C33H33N5O3/c1-40-28-13-11-25(12-14-28)16-22-41-32-31(23-35-38(33(32)39)27-7-3-2-4-8-27)37-20-18-36(19-21-37)24-26-15-17-34-30-10-6-5-9-29(26)30/h2-15,17,23H,16,18-22,24H2,1H3