4-chloranyl-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzenesulfonamide CAS Name: 4-chloro-N-[1-methyl-2-[2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]ethyl]-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzenesulfonamide Formula: C25H29ClN6O2S+2 MolecularWeight: 513.05476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C25H27ClN6O2S/c1-30-23-10-7-20(29-35(33,34)21-8-5-19(26)6-9-21)18-22(23)28-25(30)11-13-31-14-16-32(17-15-31)24-4-2-3-12-27-24/h2-10,12,18,29H,11,13-17H2,1H3/p+2