3-bromanyl-N-[1-methyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzamide

Systemtic Name: 3-bromanyl-N-[1-methyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzamide Openeye Name: 3-bromo-N-[1-methyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzamide CAS Name: 3-bromo-N-[1-methyl-2-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-5-benzimidazolyl]benzamide IUPAC Name: 3-bromo-N-[1-methyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzamide Traditional Name: 3-bromo-N-[1-methyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzimidazol-5-yl]benzamide Formula: C27H29BrN5O+ MolecularWeight: 519.45606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CC[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H28BrN5O/c1-31-25-11-10-22(29-27(34)20-6-5-7-21(28)18-20)19-24(25)30-26(31)12-13-32-14-16-33(17-15-32)23-8-3-2-4-9-23/h2-11,18-19H,12-17H2,1H3,(H,29,34)/p+1