2-(4-bromanyl-2-tert-butyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-2-tert-butyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide IUPAC Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide Formula: C14H17BrN4O2 MolecularWeight: 353.21438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=NC=NN2

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=NC=NN2

InChI

InChI=1S/C14H17BrN4O2/c1-14(2,3)10-6-9(15)4-5-11(10)21-7-12(20)18-13-16-8-17-19-13/h4-6,8H,7H2,1-3H3,(H2,16,17,18,19,20)