methyl 3-[[2-(4-carbamimidoylphenyl)-1-[2-(1H-imidazol-5-yl)ethyl]benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-[2-(1H-imidazol-5-yl)ethyl]benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-[2-(1H-imidazol-5-yl)ethyl]benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-carbamimidoylphenyl)-1-[2-(1H-imidazol-5-yl)ethyl]-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-[2-(1H-imidazol-5-yl)ethyl]benzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-1-[2-(1H-imidazol-5-yl)ethyl]benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C24H25N7O3 MolecularWeight: 459.5004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=N)N)CCC4=CN=CN4

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=N)N)CCC4=CN=CN4

InChI

InChI=1S/C24H25N7O3/c1-34-21(32)8-10-28-24(33)17-6-7-20-19(12-17)30-23(16-4-2-15(3-5-16)22(25)26)31(20)11-9-18-13-27-14-29-18/h2-7,12-14H,8-11H2,1H3,(H3,25,26)(H,27,29)(H,28,33)