Vitas-M small molecule compound
1-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
Catalog ID
STK688685
SMILES Brc1c(C)nn(c1C)C(=O)CCCn1nc(c(c1C)I)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 C14H18BrIN4O MW 465.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18BrIN4O/c1-8-13(15)10(3)20(18-8)12(21)6-5-7-19-11(4)14(16)9(2)17-19/h5-7H2,1-4H3InChIKey
XSLJWBNEPXAARF-UHFFFAOYSA-NSynonyms
1(4bromo35dimethyl1Hpyrazol1yl)4(4iodo35dimethyl1Hpyrazol1yl)butan1one
1(4BROMO35DIMETHYLPYRAZOL1YL)4(4IODO35DIMETHYLPYRAZOL1YL)BUTAN1ONE
CC1=C(C(=NN1C(=O)CCCN2C(=C(C(=N2)C)I)C)C)Br
InChI=1SC14H18BrIN4Oc1813(15)10(3)20(188)12(21)6571911(4)14(16)9(2)1719h57H214H3
MFCD07658036
ZINC000012372153
ZINC12372153
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