Vitas-M small molecule compound
2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl (4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetate
Catalog ID
STK996026
SMILES O=C(Cn1nc(c(c1C)Cl)C)OCC(=O)n1nc(c(c1C)Br)C
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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 C14H16BrClN4O3 MW 403.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16BrClN4O3/c1-7-13(15)9(3)20(18-7)11(21)6-23-12(22)5-19-10(4)14(16)8(2)17-19/h5-6H2,1-4H3InChIKey
XZXJQEKLLXVIJU-UHFFFAOYSA-NSynonyms
(2(4bromo35dimethylpyrazol1yl)2oxoethyl)2(4chloro35dimethylpyrazol1yl)acetate
2(4bromo35dimethyl1Hpyrazol1yl)2oxoethyl(4chloro35dimethyl1Hpyrazol1yl)acetate
CC1=C(C(=NN1CC(=O)OCC(=O)N2C(=C(C(=N2)C)Br)C)C)Cl
InChI=1SC14H16BrClN4O3c1713(15)9(3)20(187)11(21)62312(22)51910(4)14(16)8(2)1719h56H214H3
MFCD02648415
ZINC000051330944
ZINC51330944
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