Vitas-M small molecule compound
1-(azepan-1-yl)-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)ethanone
Catalog ID
STK839055
SMILES O=C(N1CCCCCC1)Cn1nc(c(c1C)Br)[N+](=O)[O-]
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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 C12H17BrN4O3 MW 345.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17BrN4O3/c1-9-11(13)12(17(19)20)14-16(9)8-10(18)15-6-4-2-3-5-7-15/h2-8H2,1H3InChIKey
HSISOEYBFROWNA-UHFFFAOYSA-NSynonyms
1((4BROMO3NITRO5METHYL1HPYRAZOL1YL)ACETYL)AZEPANE
1(azepan1yl)2(4bromo5methyl3nitro1Hpyrazol1yl)ethanone
1(AZEPAN1YL)2(4BROMO5METHYL3NITROPYRAZOL1YL)ETHANONE
1AZEPAN1YL2(4BROMO5METHYL3NITROPYRAZOL1YL)ETHANONE
CC1=C(C(=NN1CC(=O)N2CCCCCC2)(N+)(=O)(O))Br
InChI=1SC12H17BrN4O3c1911(13)12(17(19)20)1416(9)810(18)1564235715h28H21H3
MFCD00845064
O=C(N1CCCCCC1)Cn1nc(c(c1C)Br)(N+)(=O)(O)
ZINC000000196102
ZINC00196102
ZINC196102
Check stock
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