2-(1H-benzimidazol-2-yl)-4-chloranyl-5-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-4-chloranyl-5-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Openeye Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one CAS Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-4-iumyl]-3-pyridazinone IUPAC Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Traditional Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Formula: C20H19Cl2N6OS+ MolecularWeight: 462.37546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5N4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5N4)Cl

InChI

InChI=1S/C20H18Cl2N6OS/c21-17-6-5-13(30-17)12-26-7-9-27(10-8-26)16-11-23-28(19(29)18(16)22)20-24-14-3-1-2-4-15(14)25-20/h1-6,11H,7-10,12H2,(H,24,25)/p+1