2-[3,5-bis(bromanyl)-1,2,4-triazol-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[3,5-bis(bromanyl)-1,2,4-triazol-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C13H14Br2N4O MolecularWeight: 402.08446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN2C(=NC(=N2)Br)Br)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN2C(=NC(=N2)Br)Br)C

InChI

InChI=1S/C13H14Br2N4O/c1-3-9-6-4-5-8(2)11(9)16-10(20)7-19-13(15)17-12(14)18-19/h4-6H,3,7H2,1-2H3,(H,16,20)