benzamide; [2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl] hydrogen carbonate; hydrochloride

Systemtic Name: benzamide; [2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl] hydrogen carbonate; hydrochloride Openeye Name: benzamide; [2-[(4-carbamimidoylanilino)methyl]-1-methyl-benzimidazol-5-yl] hydrogen carbonate; hydrochloride CAS Name: benzamide; carbonic acid [2-[(4-carbamimidoylanilino)methyl]-1-methyl-5-benzimidazolyl] ester; hydrochloride IUPAC Name: benzamide; [2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazol-5-yl] hydrogen carbonate; hydrochloride Traditional Name: benzamide; carbonic acid [2-[(4-amidinoanilino)methyl]-1-methyl-benzimidazol-5-yl] ester; hydrochloride Formula: C24H25ClN6O4 MolecularWeight: 496.9461

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC(=O)O)N=C1CNC3=CC=C(C=C3)C(=N)N.C1=CC=C(C=C1)C(=O)N.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC(=O)O)N=C1CNC3=CC=C(C=C3)C(=N)N.C1=CC=C(C=C1)C(=O)N.Cl

InChI

InChI=1S/C17H17N5O3.C7H7NO.ClH/c1-22-14-7-6-12(25-17(23)24)8-13(14)21-15(22)9-20-11-4-2-10(3-5-11)16(18)19;8-7(9)6-4-2-1-3-5-6;/h2-8,20H,9H2,1H3,(H3,18,19)(H,23,24);1-5H,(H2,8,9);1H