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

Systemtic Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(4-methoxyphenyl)benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(4-methoxyphenyl)benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-carbamimidoylphenyl)-1-(4-methoxyphenyl)-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(4-methoxyphenyl)benzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-1-(4-methoxyphenyl)benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C26H25N5O4 MolecularWeight: 471.5078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)C(=O)NCCC(=O)OC)N=C2C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)C(=O)NCCC(=O)OC)N=C2C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C26H25N5O4/c1-34-20-10-8-19(9-11-20)31-22-12-7-18(26(33)29-14-13-23(32)35-2)15-21(22)30-25(31)17-5-3-16(4-6-17)24(27)28/h3-12,15H,13-14H2,1-2H3,(H3,27,28)(H,29,33)