2-(1H-benzimidazol-2-yl)-4-chloranyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-4-chloranyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-one Openeye Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-one CAS Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-(2-pyrimidinyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-one Traditional Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-(2-pyrimidyl)piperazino]pyridazin-3-one Formula: C19H17ClN8O MolecularWeight: 408.84428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4N3)Cl)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4N3)Cl)C5=NC=CC=N5

InChI

InChI=1S/C19H17ClN8O/c20-16-15(26-8-10-27(11-9-26)18-21-6-3-7-22-18)12-23-28(17(16)29)19-24-13-4-1-2-5-14(13)25-19/h1-7,12H,8-11H2,(H,24,25)