4-chloranyl-2-phenyl-5-[4-(2-quinolin-8-ylethanoyl)piperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-(2-quinolin-8-ylethanoyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[2-(8-quinolyl)acetyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[1-oxo-2-(8-quinolinyl)ethyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-(2-quinolin-8-ylacetyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[2-(8-quinolyl)acetyl]piperazino]pyridazin-3-one Formula: C25H22ClN5O2 MolecularWeight: 459.92748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H22ClN5O2/c26-23-21(17-28-31(25(23)33)20-9-2-1-3-10-20)29-12-14-30(15-13-29)22(32)16-19-7-4-6-18-8-5-11-27-24(18)19/h1-11,17H,12-16H2