5-[(2-bromanyl-4-tert-butyl-phenoxy)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole

Systemtic Name: 5-[(2-bromanyl-4-tert-butyl-phenoxy)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole Openeye Name: 5-[(2-bromo-4-tert-butyl-phenoxy)methyl]-3-(4-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole IUPAC Name: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole Traditional Name: 5-[(2-bromo-4-tert-butyl-phenoxy)methyl]-3-(4-pyridyl)-1,2,4-oxadiazole Formula: C18H18BrN3O2 MolecularWeight: 388.25842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=NC=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=NC=C3)Br

InChI

InChI=1S/C18H18BrN3O2/c1-18(2,3)13-4-5-15(14(19)10-13)23-11-16-21-17(22-24-16)12-6-8-20-9-7-12/h4-10H,11H2,1-3H3