Vitas-M small molecule compound
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]acetamide
Catalog ID
STL392972
SMILES O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])NCCn1nc(cc1C)[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 C12H14BrN7O5 MW 416.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14BrN7O5/c1-7-5-9(19(22)23)15-17(7)4-3-14-10(21)6-18-8(2)11(13)12(16-18)20(24)25/h5H,3-4,6H2,1-2H3,(H,14,21)InChIKey
LUNCKLAQBJDESQ-UHFFFAOYSA-NSynonyms
1005590-90-81005590908
2(4BROMO5METHYL3NITRO1HPYRAZOL1YL)N(2(5METHYL3NITRO1HPYRAZOL1YL)ETHYL)ACETAMIDE
2(4bromo5methyl3nitropyrazol1yl)N(2(5methyl3nitropyrazol1yl)ethyl)acetamide
CC1=CC(=NN1CCNC(=O)CN2C(=C(C(=N2)(N+)(=O)(O))Br)C)(N+)(=O)(O)
InChI=1SC12H14BrN7O5c1759(19(22)23)1517(7)431410(21)6188(2)11(13)12(1618)20(24)25h5H346H212H3(H1421)
MFCD04047073
O=C(Cn1nc(c(c1C)Br)(N+)(=O)(O))NCCn1nc(cc1C)(N+)(=O)(O)
ZINC000002791992
ZINC02791992
ZINC2791992
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