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

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-(4-bromo-2,5-dimethylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-(4-bromo-2,5-dimethyl-phenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide Formula: C12H13BrN4O2 MolecularWeight: 325.16122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)OCC(=O)NC2=NC=NN2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)OCC(=O)NC2=NC=NN2

InChI

InChI=1S/C12H13BrN4O2/c1-7-4-10(8(2)3-9(7)13)19-5-11(18)16-12-14-6-15-17-12/h3-4,6H,5H2,1-2H3,(H2,14,15,16,17,18)