2-[2-(4-carbamimidoylphenyl)ethyl]-N-[(4-carbamimidoylphenyl)methyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide

Systemtic Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[(4-carbamimidoylphenyl)methyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Openeye Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[(4-carbamimidoylphenyl)methyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide CAS Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[(4-carbamimidoylphenyl)methyl]-1-methyl-N-(3-phenylpropyl)-5-benzimidazolecarboxamide IUPAC Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[(4-carbamimidoylphenyl)methyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Traditional Name: N-(4-amidinobenzyl)-2-[2-(4-amidinophenyl)ethyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Formula: C35H37N7O MolecularWeight: 571.71458

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N(CCCC3=CC=CC=C3)CC4=CC=C(C=C4)C(=N)N)N=C1CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N(CCCC3=CC=CC=C3)CC4=CC=C(C=C4)C(=N)N)N=C1CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C35H37N7O/c1-41-31-19-18-29(22-30(31)40-32(41)20-13-25-9-14-27(15-10-25)33(36)37)35(43)42(21-5-8-24-6-3-2-4-7-24)23-26-11-16-28(17-12-26)34(38)39/h2-4,6-7,9-12,14-19,22H,5,8,13,20-21,23H2,1H3,(H3,36,37)(H3,38,39)