N-(3-azanyl-3-azanylidene-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-N-cyclooctyl-1-methyl-benzimidazole-5-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-N-cyclooctyl-1-methyl-benzimidazole-5-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-N-cyclooctyl-1-methyl-benzimidazole-5-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-N-cyclooctyl-1-methyl-5-benzimidazolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-N-cyclooctyl-1-methylbenzimidazole-5-carboxamide Traditional Name: 2-[2-(4-amidinophenyl)ethyl]-N-(3-amino-3-imino-propyl)-N-cyclooctyl-1-methyl-benzimidazole-5-carboxamide Formula: C29H39N7O MolecularWeight: 501.66626

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N(CCC(=N)N)C3CCCCCCC3)N=C1CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N(CCC(=N)N)C3CCCCCCC3)N=C1CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C29H39N7O/c1-35-25-15-14-22(29(37)36(18-17-26(30)31)23-7-5-3-2-4-6-8-23)19-24(25)34-27(35)16-11-20-9-12-21(13-10-20)28(32)33/h9-10,12-15,19,23H,2-8,11,16-18H2,1H3,(H3,30,31)(H3,32,33)