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

Systemtic Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-benzimidazol-5-yl]-N-methyl-2-[4-(pyridin-2-ylamino)piperidin-1-yl]ethanamide Openeye Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-benzimidazol-5-yl]-N-methyl-2-[4-(2-pyridylamino)-1-piperidyl]acetamide CAS Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methyl-5-benzimidazolyl]-N-methyl-2-[4-(2-pyridinylamino)-1-piperidinyl]acetamide IUPAC Name: N-[2-[2-(4-carbamimidoylphenyl)ethyl]-1-methylbenzimidazol-5-yl]-N-methyl-2-[4-(pyridin-2-ylamino)piperidin-1-yl]acetamide Traditional Name: N-[2-[2-(4-amidinophenyl)ethyl]-1-methyl-benzimidazol-5-yl]-N-methyl-2-[4-(2-pyridylamino)piperidino]acetamide Formula: C30H36N8O MolecularWeight: 524.65984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N(C)C(=O)CN3CCC(CC3)NC4=CC=CC=N4)N=C1CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)N(C)C(=O)CN3CCC(CC3)NC4=CC=CC=N4)N=C1CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C30H36N8O/c1-36(29(39)20-38-17-14-23(15-18-38)34-27-5-3-4-16-33-27)24-11-12-26-25(19-24)35-28(37(26)2)13-8-21-6-9-22(10-7-21)30(31)32/h3-7,9-12,16,19,23H,8,13-15,17-18,20H2,1-2H3,(H3,31,32)(H,33,34)