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

Systemtic Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(3-phenylprop-2-ynyl)-3H-benzimidazole-5-carboxamide Openeye Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(3-phenylprop-2-ynyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(3-phenylprop-2-ynyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(3-phenylprop-2-ynyl)-3H-benzimidazole-5-carboxamide Traditional Name: 2-[[6-(aminomethyl)-1H-benzimidazol-2-yl]methyl]-N-(3-phenylprop-2-ynyl)-3H-benzimidazole-5-carboxamide Formula: C26H22N6O MolecularWeight: 434.49248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCNC(=O)C2=CC3=C(C=C2)N=C(N3)CC4=NC5=C(N4)C=C(C=C5)CN

Isomeric SMILES

C1=CC=C(C=C1)C#CCNC(=O)C2=CC3=C(C=C2)N=C(N3)CC4=NC5=C(N4)C=C(C=C5)CN

InChI

InChI=1S/C26H22N6O/c27-16-18-8-10-20-22(13-18)31-24(29-20)15-25-30-21-11-9-19(14-23(21)32-25)26(33)28-12-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,13-14H,12,15-16,27H2,(H,28,33)(H,29,31)(H,30,32)