4-chloranyl-2-phenyl-5-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-2-phenyl-5-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[2-(4-pyridyl)ethyl]piperazino]pyridazin-3-one Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=NC=C2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCC2=CC=NC=C2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H22ClN5O/c22-20-19(16-24-27(21(20)28)18-4-2-1-3-5-18)26-14-12-25(13-15-26)11-8-17-6-9-23-10-7-17/h1-7,9-10,16H,8,11-15H2