3-[[4-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: 3-[[4-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: 3-[[4-(1H-benzimidazol-2-yl)-2-chloro-phenyl]methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[[4-(1H-benzimidazol-2-yl)-2-chlorophenyl]methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylate IUPAC Name: 3-[[4-(1H-benzimidazol-2-yl)-2-chlorophenyl]methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-[4-(1H-benzimidazol-2-yl)-2-chloro-benzyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate Formula: C22H15ClN5O2- MolecularWeight: 416.8398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)C4=NC5=CC=CC=C5N4)Cl)N=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)C4=NC5=CC=CC=C5N4)Cl)N=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C22H16ClN5O2/c1-12-24-18-8-9-19(22(29)30)27-21(18)28(12)11-14-7-6-13(10-15(14)23)20-25-16-4-2-3-5-17(16)26-20/h2-10H,11H2,1H3,(H,25,26)(H,29,30)/p-1