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

Systemtic Name: N-[1-methyl-2-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]cyclohexanecarboxamide Openeye Name: N-[1-methyl-2-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]cyclohexanecarboxamide CAS Name: N-[1-methyl-2-[2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethyl]-5-benzimidazolyl]cyclohexanecarboxamide IUPAC Name: N-[1-methyl-2-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]cyclohexanecarboxamide Traditional Name: N-[1-methyl-2-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]cyclohexanecarboxamide Formula: C26H35N6O+ MolecularWeight: 447.5957

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3CCCCC3)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3CCCCC3)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C26H34N6O/c1-30-23-11-10-21(28-26(33)20-7-3-2-4-8-20)19-22(23)29-25(30)12-14-31-15-17-32(18-16-31)24-9-5-6-13-27-24/h5-6,9-11,13,19-20H,2-4,7-8,12,14-18H2,1H3,(H,28,33)/p+1