Vitas-M small molecule compound
2-(3,5-dibromo-1H-1,2,4-triazol-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone
Catalog ID
STK282978
SMILES Brc1nn(c(n1)Br)CC(=O)c1ccc2c(c1)OCCO2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H9Br2N3O3 MW 403.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9Br2N3O3/c13-11-15-12(14)17(16-11)6-8(18)7-1-2-9-10(5-7)20-4-3-19-9/h1-2,5H,3-4,6H2InChIKey
HDMQUYRZKSGKCC-UHFFFAOYSA-NSynonyms
2(35dibromo124triazol1yl)1(23dihydro14benzodioxin6yl)ethanone
2(35dibromo1H124triazol1yl)1(23dihydro14benzodioxin6yl)ethanone
C1COC2=C(O1)C=CC(=C2)C(=O)CN3C(=NC(=N3)Br)Br
InChI=1SC12H9Br2N3O3c13111512(14)17(1611)68(18)712910(57)2043199h125H346H2
MFCD09270677
ZINC000008296508
ZINC08296508
ZINC8296508
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