N-[1-methyl-2-[2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]furan-2-carboxamide

Systemtic Name: N-[1-methyl-2-[2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]furan-2-carboxamide Openeye Name: N-[1-methyl-2-[2-[4-(p-tolyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]furan-2-carboxamide CAS Name: N-[1-methyl-2-[2-[4-(4-methylphenyl)-1-piperazin-1-iumyl]ethyl]-5-benzimidazolyl]-2-furancarboxamide IUPAC Name: N-[1-methyl-2-[2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]furan-2-carboxamide Traditional Name: N-[1-methyl-2-[2-[4-(p-tolyl)piperazin-1-ium-1-yl]ethyl]benzimidazol-5-yl]-2-furamide Formula: C26H30N5O2+ MolecularWeight: 444.5487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC[NH+](CC2)CCC3=NC4=C(N3C)C=CC(=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=CC=C(C=C1)N2CC[NH+](CC2)CCC3=NC4=C(N3C)C=CC(=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C26H29N5O2/c1-19-5-8-21(9-6-19)31-15-13-30(14-16-31)12-11-25-28-22-18-20(7-10-23(22)29(25)2)27-26(32)24-4-3-17-33-24/h3-10,17-18H,11-16H2,1-2H3,(H,27,32)/p+1