methyl 3-[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]-2-ethyl-7-methyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]-2-ethyl-7-methyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]-2-ethyl-7-methyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[2-(2-aminophenyl)-3-bromo-5-benzofuranyl]-2-ethyl-7-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2-aminophenyl)-3-bromo-1-benzofuran-5-yl]-2-ethyl-7-methylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]-2-ethyl-7-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C25H21BrN4O3 MolecularWeight: 505.36324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC4=C(C=C3)OC(=C4Br)C5=CC=CC=C5N)N=C(C=C2C)C(=O)OC

Isomeric SMILES

CCC1=NC2=C(N1C3=CC4=C(C=C3)OC(=C4Br)C5=CC=CC=C5N)N=C(C=C2C)C(=O)OC

InChI

InChI=1S/C25H21BrN4O3/c1-4-20-29-22-13(2)11-18(25(31)32-3)28-24(22)30(20)14-9-10-19-16(12-14)21(26)23(33-19)15-7-5-6-8-17(15)27/h5-12H,4,27H2,1-3H3