ethyl 3-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-2,5-diethyl-imidazole-4-carboxylate

Systemtic Name: ethyl 3-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-2,5-diethyl-imidazole-4-carboxylate Openeye Name: ethyl 3-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-2,5-diethyl-imidazole-4-carboxylate CAS Name: 3-[[2-(2-aminophenyl)-3-bromo-5-benzofuranyl]methyl]-2,5-diethyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-aminophenyl)-3-bromo-1-benzofuran-5-yl]methyl]-2,5-diethylimidazole-4-carboxylate Traditional Name: 3-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-2,5-diethyl-imidazole-4-carboxylic acid ethyl ester Formula: C25H26BrN3O3 MolecularWeight: 496.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=N1)CC)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N)C(=O)OCC

Isomeric SMILES

CCC1=C(N(C(=N1)CC)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N)C(=O)OCC

InChI

InChI=1S/C25H26BrN3O3/c1-4-19-23(25(30)31-6-3)29(21(5-2)28-19)14-15-11-12-20-17(13-15)22(26)24(32-20)16-9-7-8-10-18(16)27/h7-13H,4-6,14,27H2,1-3H3