Vitas-M small molecule compound

(4-bromo-1-methyl-1H-pyrazol-3-yl)(5-methyl-3-nitro-1H-pyrazol-1-yl)methanone

Catalog ID
STK048222
SMILES Cn1cc(c(n1)C(=O)n1nc(cc1C)[N+](=O)[O-])Br

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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 C9H8BrN5O3 MW 314.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8BrN5O3/c1-5-3-7(15(17)18)11-14(5)9(16)8-6(10)4-13(2)12-8/h3-4H,1-2H3
InChIKey
YWNGYFRGJXXCAI-UHFFFAOYSA-N
Synonyms
312512-68-8
(4BROMO1METHYL1HPYRAZOL3YL)(5METHYL3NITRO1HPYRAZOL1YL)METHANONE
(4BROMO1METHYL1HPYRAZOL3YL)(5METHYL3NITROPYRAZOL1YL)METHANONE
(4BROMO1METHYLPYRAZOL3YL)(5METHYL3NITROPYRAZOL1YL)METHANONE
312512688
CC1=CC(=NN1C(=O)C2=NN(C=C2Br)C)(N+)(=O)(O)
Cn1cc(c(n1)C(=O)n1nc(cc1C)(N+)(=O)(O))Br
InChI=1SC9H8BrN5O3c1537(15(17)18)1114(5)9(16)86(10)413(2)128h34H12H3
MFCD01572381
STK048222
ZINC000000076921
ZINC00076921
ZINC76921

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Available files

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