2-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]ethyl-methoxy-phosphinic acid

Systemtic Name: 2-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]ethyl-methoxy-phosphinic acid Openeye Name: 2-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazole-5-carbonyl]amino]ethyl-methoxy-phosphinic acid CAS Name: 2-[[[2-(4-carbamimidoylphenyl)-1-methyl-5-benzimidazolyl]-oxomethyl]amino]ethyl-methoxyphosphinic acid IUPAC Name: 2-[[2-(4-carbamimidoylphenyl)-1-methylbenzimidazole-5-carbonyl]amino]ethyl-methoxyphosphinic acid Traditional Name: 2-[[2-(4-amidinophenyl)-1-methyl-benzimidazole-5-carbonyl]amino]ethyl-methoxy-phosphinic acid Formula: C19H22N5O4P MolecularWeight: 415.382841

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCP(=O)(O)OC)N=C1C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCP(=O)(O)OC)N=C1C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H22N5O4P/c1-24-16-8-7-14(19(25)22-9-10-29(26,27)28-2)11-15(16)23-18(24)13-5-3-12(4-6-13)17(20)21/h3-8,11H,9-10H2,1-2H3,(H3,20,21)(H,22,25)(H,26,27)