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

Systemtic Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Openeye Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide CAS Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-(3-phenylpropyl)-5-benzimidazolecarboxamide IUPAC Name: 2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Traditional Name: 2-[2-(4-amidinophenyl)ethyl]-1-methyl-N-(3-phenylpropyl)benzimidazole-5-carboxamide Formula: C27H29N5O MolecularWeight: 439.55206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCCC3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCCC3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C27H29N5O/c1-32-24-15-14-22(27(33)30-17-5-8-19-6-3-2-4-7-19)18-23(24)31-25(32)16-11-20-9-12-21(13-10-20)26(28)29/h2-4,6-7,9-10,12-15,18H,5,8,11,16-17H2,1H3,(H3,28,29)(H,30,33)