Vitas-M small molecule compound
N-{4-[acetyl(methyl)amino]phenyl}-4-bromo-5-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK316652
SMILES CC(=O)N(c1ccc(cc1)NC(=O)c1n[nH]c(c1Br)[N+](=O)[O-])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 C13H12BrN5O4 MW 382.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrN5O4/c1-7(20)18(2)9-5-3-8(4-6-9)15-13(21)11-10(14)12(17-16-11)19(22)23/h3-6H,1-2H3,(H,15,21)(H,16,17)InChIKey
HGTNBXJZMMFHSV-UHFFFAOYSA-NSynonyms
1092808-05-31092808053
CC(=O)N(C)C1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)(N+)(=O)(O))Br
CC(=O)N(c1ccc(cc1)NC(=O)c1n(nH)c(c1Br)(N+)(=O)(O))C
InChI=1SC13H12BrN5O4c17(20)18(2)9538(469)1513(21)1110(14)12(171611)19(22)23h36H12H3(H1521)(H1617)
MFCD03072112
N(4(acetyl(methyl)amino)phenyl)4bromo3nitro1Hpyrazole5carboxamide
N(4(acetyl(methyl)amino)phenyl)4bromo5nitro1Hpyrazole3carboxamide
ZINC000012649132
ZINC12649132
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