2-[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboximidamide trihydrochloride

Systemtic Name: 2-[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboximidamide trihydrochloride Openeye Name: 2-[2-(4-benzyloxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamidine trihydrochloride CAS Name: 2-[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboximidamide trihydrochloride IUPAC Name: 2-[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboximidamide trihydrochloride Traditional Name: 2-[2-(4-benzoxyphenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamidine trihydrochloride Formula: C28H25Cl3N6O MolecularWeight: 567.8967

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=N)N.Cl.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=N)N.Cl.Cl.Cl

InChI

InChI=1S/C28H22N6O.3ClH/c29-26(30)19-8-12-22-24(14-19)34-28(32-22)20-9-13-23-25(15-20)33-27(31-23)18-6-10-21(11-7-18)35-16-17-4-2-1-3-5-17;;;/h1-15H,16H2,(H3,29,30)(H,31,33)(H,32,34);3*1H