Vitas-M small molecule compound
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-chloro-2-methoxyphenyl)acetamide
Catalog ID
STK342580
SMILES COc1cc(Cl)ccc1NC(=O)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 C13H12BrClN4O4 MW 403.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrClN4O4/c1-7-12(14)13(19(21)22)17-18(7)6-11(20)16-9-4-3-8(15)5-10(9)23-2/h3-5H,6H2,1-2H3,(H,16,20)InChIKey
ZZYSPKIMXSDBQE-UHFFFAOYSA-NSynonyms
353455-46-62(4bromo5methyl3nitro1Hpyrazol1yl)N(4chloro2methoxyphenyl)acetamide
2(4BROMO5METHYL3NITROPYRAZOL1YL)N(4CHLORO2METHOXYPHENYL)ACETAMIDE
353455466
CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Cl)OC)(N+)(=O)(O))Br
COc1cc(Cl)ccc1NC(=O)Cn1nc(c(c1C)Br)(N+)(=O)(O)
InChI=1SC13H12BrClN4O4c1712(14)13(19(21)22)1718(7)611(20)169438(15)510(9)232h35H6H212H3(H1620)
MFCD00981665
ZINC000001300830
ZINC01300830
ZINC1300830
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