2-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)acetamide IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)acetamide Formula: C12H13BrN4O3 MolecularWeight: 341.16062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)NC2=NC=NN2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)NC2=NC=NN2)Br)OC

InChI

InChI=1S/C12H13BrN4O3/c1-19-9-3-7(8(13)5-10(9)20-2)4-11(18)16-12-14-6-15-17-12/h3,5-6H,4H2,1-2H3,(H2,14,15,16,17,18)