(1-methylbenzimidazol-5-yl) N-[(4-carbamimidoylphenyl)methyl]-N-[3-(4-carbamimidoylphenyl)propyl]carbamate

Systemtic Name: (1-methylbenzimidazol-5-yl) N-[(4-carbamimidoylphenyl)methyl]-N-[3-(4-carbamimidoylphenyl)propyl]carbamate Openeye Name: (1-methylbenzimidazol-5-yl) N-[(4-carbamimidoylphenyl)methyl]-N-[3-(4-carbamimidoylphenyl)propyl]carbamate CAS Name: N-[(4-carbamimidoylphenyl)methyl]-N-[3-(4-carbamimidoylphenyl)propyl]carbamic acid (1-methyl-5-benzimidazolyl) ester IUPAC Name: (1-methylbenzimidazol-5-yl) N-[(4-carbamimidoylphenyl)methyl]-N-[3-(4-carbamimidoylphenyl)propyl]carbamate Traditional Name: N-(4-amidinobenzyl)-N-[3-(4-amidinophenyl)propyl]carbamic acid (1-methylbenzimidazol-5-yl) ester Formula: C27H29N7O2 MolecularWeight: 483.56486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCCC3=CC=C(C=C3)C(=N)N)CC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCCC3=CC=C(C=C3)C(=N)N)CC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C27H29N7O2/c1-33-17-32-23-15-22(12-13-24(23)33)36-27(35)34(16-19-6-10-21(11-7-19)26(30)31)14-2-3-18-4-8-20(9-5-18)25(28)29/h4-13,15,17H,2-3,14,16H2,1H3,(H3,28,29)(H3,30,31)