[4-(6-bromanyl-2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-1-benzofuran-2-yl] 2-fluoranylbenzoate

Systemtic Name: [4-(6-bromanyl-2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-1-benzofuran-2-yl] 2-fluoranylbenzoate Openeye Name: [4-(6-bromo-2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-benzofuran-2-yl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [4-(6-bromo-2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)-3-methyl-2-benzofuranyl] ester IUPAC Name: [4-(6-bromo-2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)-3-methyl-1-benzofuran-2-yl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [4-(6-bromo-2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-benzofuran-2-yl] ester Formula: C26H21BrFN3O3 MolecularWeight: 522.365643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C(N=C2N1C3=C4C(=C(OC4=CC=C3)OC(=O)C5=CC=CC=C5F)C)C)Br)C

Isomeric SMILES

CCC1=NC2=C(C(=C(N=C2N1C3=C4C(=C(OC4=CC=C3)OC(=O)C5=CC=CC=C5F)C)C)Br)C

InChI

InChI=1S/C26H21BrFN3O3/c1-5-20-30-23-14(3)22(27)15(4)29-24(23)31(20)18-11-8-12-19-21(18)13(2)26(33-19)34-25(32)16-9-6-7-10-17(16)28/h6-12H,5H2,1-4H3