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

Systemtic Name: [4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-1-benzofuran-2-yl] 2-fluoranylbenzoate Openeye Name: [4-(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-(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)-3-methyl-2-benzofuranyl] ester IUPAC Name: [4-(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-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-3-methyl-benzofuran-2-yl] ester Formula: C26H22FN3O3 MolecularWeight: 443.469583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=C4C(=C(OC4=CC=C3)OC(=O)C5=CC=CC=C5F)C)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1C3=C4C(=C(OC4=CC=C3)OC(=O)C5=CC=CC=C5F)C)N=C(C=C2C)C

InChI

InChI=1S/C26H22FN3O3/c1-5-21-29-23-14(2)13-15(3)28-24(23)30(21)19-11-8-12-20-22(19)16(4)26(32-20)33-25(31)17-9-6-7-10-18(17)27/h6-13H,5H2,1-4H3