2-[[6-[bis(azanyl)methylideneamino]-1H-benzimidazol-2-yl]methyl]-3-methyl-N-(2-oxidanyl-2-quinolin-4-yl-ethyl)benzimidazole-5-carboxamide

Systemtic Name: 2-[[6-[bis(azanyl)methylideneamino]-1H-benzimidazol-2-yl]methyl]-3-methyl-N-(2-oxidanyl-2-quinolin-4-yl-ethyl)benzimidazole-5-carboxamide Openeye Name: 2-[(6-guanidino-1H-benzimidazol-2-yl)methyl]-N-[2-hydroxy-2-(4-quinolyl)ethyl]-3-methyl-benzimidazole-5-carboxamide CAS Name: 2-[[6-(diaminomethylideneamino)-1H-benzimidazol-2-yl]methyl]-N-[2-hydroxy-2-(4-quinolinyl)ethyl]-3-methyl-5-benzimidazolecarboxamide IUPAC Name: 2-[[6-(diaminomethylideneamino)-1H-benzimidazol-2-yl]methyl]-N-(2-hydroxy-2-quinolin-4-ylethyl)-3-methylbenzimidazole-5-carboxamide Traditional Name: 2-[(6-guanidino-1H-benzimidazol-2-yl)methyl]-N-[2-hydroxy-2-(4-quinolyl)ethyl]-3-methyl-benzimidazole-5-carboxamide Formula: C29H27N9O2 MolecularWeight: 533.58378

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCC(C3=CC=NC4=CC=CC=C34)O)N=C1CC5=NC6=C(N5)C=C(C=C6)N=C(N)N

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCC(C3=CC=NC4=CC=CC=C34)O)N=C1CC5=NC6=C(N5)C=C(C=C6)N=C(N)N

InChI

InChI=1S/C29H27N9O2/c1-38-24-12-16(28(40)33-15-25(39)19-10-11-32-20-5-3-2-4-18(19)20)6-8-22(24)37-27(38)14-26-35-21-9-7-17(34-29(30)31)13-23(21)36-26/h2-13,25,39H,14-15H2,1H3,(H,33,40)(H,35,36)(H4,30,31,34)