tert-butyl N-[1-(benzimidazol-1-yl)-3-(5-bromanylpyridin-3-yl)oxy-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(benzimidazol-1-yl)-3-(5-bromanylpyridin-3-yl)oxy-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(benzimidazol-1-ylmethyl)-2-[(5-bromo-3-pyridyl)oxy]ethyl]carbamate CAS Name: N-[1-(1-benzimidazolyl)-3-[(5-bromo-3-pyridinyl)oxy]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(benzimidazol-1-yl)-3-(5-bromopyridin-3-yl)oxypropan-2-yl]carbamate Traditional Name: N-[1-(benzimidazol-1-ylmethyl)-2-[(5-bromo-3-pyridyl)oxy]ethyl]carbamic acid tert-butyl ester Formula: C20H23BrN4O3 MolecularWeight: 447.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CN1C=NC2=CC=CC=C21)COC3=CC(=CN=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)NC(CN1C=NC2=CC=CC=C21)COC3=CC(=CN=C3)Br

InChI

InChI=1S/C20H23BrN4O3/c1-20(2,3)28-19(26)24-15(12-27-16-8-14(21)9-22-10-16)11-25-13-23-17-6-4-5-7-18(17)25/h4-10,13,15H,11-12H2,1-3H3,(H,24,26)