N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-benzimidazol-5-yl]-2-[4-[methyl(pyridin-2-yl)amino]piperidin-1-yl]-N-(naphthalen-1-ylmethyl)ethanamide

Systemtic Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-benzimidazol-5-yl]-2-[4-[methyl(pyridin-2-yl)amino]piperidin-1-yl]-N-(naphthalen-1-ylmethyl)ethanamide Openeye Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-benzimidazol-5-yl]-2-[4-[methyl(2-pyridyl)amino]-1-piperidyl]-N-(1-naphthylmethyl)acetamide CAS Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-5-benzimidazolyl]-2-[4-[methyl(2-pyridinyl)amino]-1-piperidinyl]-N-(1-naphthalenylmethyl)acetamide IUPAC Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methylbenzimidazol-5-yl]-2-[4-[methyl(pyridin-2-yl)amino]piperidin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide Traditional Name: N-[2-[2-(4-amidinophenyl)ethyl]-1-methyl-benzimidazol-5-yl]-2-[4-[methyl(2-pyridyl)amino]piperidino]-N-(1-naphthylmethyl)acetamide Formula: C41H44N8O MolecularWeight: 664.84106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N(CC3=CC=CC4=CC=CC=C43)C(=O)CN5CCC(CC5)N(C)C6=CC=CC=N6)N=C1CCC7=CC=C(C=C7)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)N(CC3=CC=CC4=CC=CC=C43)C(=O)CN5CCC(CC5)N(C)C6=CC=CC=N6)N=C1CCC7=CC=C(C=C7)C(=N)N

InChI

InChI=1S/C41H44N8O/c1-46(38-12-5-6-23-44-38)33-21-24-48(25-22-33)28-40(50)49(27-32-10-7-9-30-8-3-4-11-35(30)32)34-18-19-37-36(26-34)45-39(47(37)2)20-15-29-13-16-31(17-14-29)41(42)43/h3-14,16-19,23,26,33H,15,20-22,24-25,27-28H2,1-2H3,(H3,42,43)