2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-[4-(2-oxidanylidene-3-phenyl-imidazolidin-1-yl)piperidin-1-yl]benzimidazole-5-carboxamide

Systemtic Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-[4-(2-oxidanylidene-3-phenyl-imidazolidin-1-yl)piperidin-1-yl]benzimidazole-5-carboxamide Openeye Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-[4-(2-oxo-3-phenyl-imidazolidin-1-yl)-1-piperidyl]benzimidazole-5-carboxamide CAS Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-[4-(2-oxo-3-phenyl-1-imidazolidinyl)-1-piperidinyl]-5-benzimidazolecarboxamide IUPAC Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-[4-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-1-yl]benzimidazole-5-carboxamide Traditional Name: 2-[2-(4-amidinophenyl)ethyl]-N-[4-(2-keto-3-phenyl-imidazolidin-1-yl)piperidino]-1-methyl-benzimidazole-5-carboxamide Formula: C32H36N8O2 MolecularWeight: 564.68064

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NN3CCC(CC3)N4CCN(C4=O)C5=CC=CC=C5)N=C1CCC6=CC=C(C=C6)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NN3CCC(CC3)N4CCN(C4=O)C5=CC=CC=C5)N=C1CCC6=CC=C(C=C6)C(=N)N

InChI

InChI=1S/C32H36N8O2/c1-37-28-13-12-24(21-27(28)35-29(37)14-9-22-7-10-23(11-8-22)30(33)34)31(41)36-38-17-15-26(16-18-38)40-20-19-39(32(40)42)25-5-3-2-4-6-25/h2-8,10-13,21,26H,9,14-20H2,1H3,(H3,33,34)(H,36,41)