2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(4-azanylbutyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(4-azanylbutyl)-3H-benzimidazole-5-carboxamide Openeye Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(4-aminobutyl)-2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carboxamide Formula: C21H25N7O MolecularWeight: 391.4695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CN)NC(=N2)CC3=NC4=C(N3)C=C(C=C4)C(=O)NCCCCN

Isomeric SMILES

C1=CC2=C(C=C1CN)NC(=N2)CC3=NC4=C(N3)C=C(C=C4)C(=O)NCCCCN

InChI

InChI=1S/C21H25N7O/c22-7-1-2-8-24-21(29)14-4-6-16-18(10-14)28-20(26-16)11-19-25-15-5-3-13(12-23)9-17(15)27-19/h3-6,9-10H,1-2,7-8,11-12,22-23H2,(H,24,29)(H,25,27)(H,26,28)