2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(4-azanylbutyl)-3-methyl-benzimidazole-4-carboxamide

Systemtic Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(4-azanylbutyl)-3-methyl-benzimidazole-4-carboxamide Openeye Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3-methyl-benzimidazole-4-carboxamide CAS Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3-methyl-4-benzimidazolecarboxamide IUPAC Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3-methylbenzimidazole-4-carboxamide Traditional Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3-methyl-benzimidazole-4-carboxamide Formula: C22H27N7O MolecularWeight: 405.49608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC(=C21)C(=O)NCCCCN)CC3=NC4=C(N3)C=C(C=C4)CN

Isomeric SMILES

CN1C(=NC2=CC=CC(=C21)C(=O)NCCCCN)CC3=NC4=C(N3)C=C(C=C4)CN

InChI

InChI=1S/C22H27N7O/c1-29-20(12-19-26-16-8-7-14(13-24)11-18(16)27-19)28-17-6-4-5-15(21(17)29)22(30)25-10-3-2-9-23/h4-8,11H,2-3,9-10,12-13,23-24H2,1H3,(H,25,30)(H,26,27)