5-chloranyl-4-[4-(7H-purin-6-yl)piperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[4-(7H-purin-6-yl)piperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[4-(7H-purin-6-yl)piperazin-1-yl]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[4-(7H-purin-6-yl)-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[4-(7H-purin-6-yl)piperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[4-(7H-purin-6-yl)piperazino]-1H-pyridazin-6-one Formula: C13H13ClN8O MolecularWeight: 332.74832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C13H13ClN8O/c14-9-8(5-19-20-13(9)23)21-1-3-22(4-2-21)12-10-11(16-6-15-10)17-7-18-12/h5-7H,1-4H2,(H,20,23)(H,15,16,17,18)