2-[(4-carbamimidoylphenyl)methyl]-N,1-dimethyl-N-pyridin-3-yl-benzimidazole-5-carboxamide hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)methyl]-N,1-dimethyl-N-pyridin-3-yl-benzimidazole-5-carboxamide hydrochloride Openeye Name: 2-[(4-carbamimidoylphenyl)methyl]-N,1-dimethyl-N-(3-pyridyl)benzimidazole-5-carboxamide hydrochloride CAS Name: 2-[(4-carbamimidoylphenyl)methyl]-N,1-dimethyl-N-(3-pyridinyl)-5-benzimidazolecarboxamide hydrochloride IUPAC Name: 2-[(4-carbamimidoylphenyl)methyl]-N,1-dimethyl-N-pyridin-3-ylbenzimidazole-5-carboxamide hydrochloride Traditional Name: 2-(4-amidinobenzyl)-N,1-dimethyl-N-(3-pyridyl)benzimidazole-5-carboxamide hydrochloride Formula: C23H23ClN6O MolecularWeight: 434.92132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N(C)C3=CN=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N(C)C3=CN=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C23H22N6O.ClH/c1-28(18-4-3-11-26-14-18)23(30)17-9-10-20-19(13-17)27-21(29(20)2)12-15-5-7-16(8-6-15)22(24)25;/h3-11,13-14H,12H2,1-2H3,(H3,24,25);1H