2-[2-(4-carbamimidoylphenyl)ethyl]-N-[2-(2-cyclohexylethyl)piperazin-1-yl]-1-methyl-benzimidazole-5-carboxamide

Systemtic Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[2-(2-cyclohexylethyl)piperazin-1-yl]-1-methyl-benzimidazole-5-carboxamide Openeye Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[2-(2-cyclohexylethyl)piperazin-1-yl]-1-methyl-benzimidazole-5-carboxamide CAS Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[2-(2-cyclohexylethyl)-1-piperazinyl]-1-methyl-5-benzimidazolecarboxamide IUPAC Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-N-[2-(2-cyclohexylethyl)piperazin-1-yl]-1-methylbenzimidazole-5-carboxamide Traditional Name: 2-[2-(4-amidinophenyl)ethyl]-N-[2-(2-cyclohexylethyl)piperazino]-1-methyl-benzimidazole-5-carboxamide Formula: C30H41N7O MolecularWeight: 515.69284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NN3CCNCC3CCC4CCCCC4)N=C1CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NN3CCNCC3CCC4CCCCC4)N=C1CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C30H41N7O/c1-36-27-15-13-24(19-26(27)34-28(36)16-10-22-7-11-23(12-8-22)29(31)32)30(38)35-37-18-17-33-20-25(37)14-9-21-5-3-2-4-6-21/h7-8,11-13,15,19,21,25,33H,2-6,9-10,14,16-18,20H2,1H3,(H3,31,32)(H,35,38)