ethyl 3-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-propyl-imidazole-4-carboxylate

Systemtic Name: ethyl 3-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-propyl-imidazole-4-carboxylate Openeye Name: ethyl 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-2-butyl-5-propyl-imidazole-4-carboxylate CAS Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]methyl]-2-butyl-5-propyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-propylimidazole-4-carboxylate Traditional Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-2-butyl-5-propyl-imidazole-4-carboxylic acid ethyl ester Formula: C29H31BrN6O3 MolecularWeight: 591.49884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)OCC)CCC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)OCC)CCC

InChI

InChI=1S/C29H31BrN6O3/c1-4-7-13-24-31-22(10-5-2)26(29(37)38-6-3)36(24)17-18-14-15-23-21(16-18)25(30)27(39-23)19-11-8-9-12-20(19)28-32-34-35-33-28/h8-9,11-12,14-16H,4-7,10,13,17H2,1-3H3,(H,32,33,34,35)