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

Systemtic Name: 2-chloranyl-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]benzamide Openeye Name: 2-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]benzamide CAS Name: 2-chloro-N-[1-methyl-2-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-benzimidazolyl]benzamide IUPAC Name: 2-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]benzamide Traditional Name: 2-chloro-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]benzimidazol-5-yl]benzamide Formula: C26H28ClN6O+ MolecularWeight: 475.99312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Cl)N=C1CCN4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Cl)N=C1CCN4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C26H27ClN6O/c1-31-23-10-9-19(29-26(34)20-6-2-3-7-21(20)27)18-22(23)30-25(31)11-13-32-14-16-33(17-15-32)24-8-4-5-12-28-24/h2-10,12,18H,11,13-17H2,1H3,(H,29,34)/p+1