Vitas-M small molecule compound

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

Catalog ID
STK760264
SMILES Cn1nc(c(c1)[N+](=O)[O-])C(=O)n1nc(c(c1C)Br)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 C10H10BrN5O3 MW 328.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10BrN5O3/c1-5-8(11)6(2)15(12-5)10(17)9-7(16(18)19)4-14(3)13-9/h4H,1-3H3
InChIKey
MEIVWFDITVNVFN-UHFFFAOYSA-N
Synonyms

(4bromo35dimethyl1Hpyrazol1yl)(1methyl4nitro1Hpyrazol3yl)methanone
(4BROMO35DIMETHYLPYRAZOL1YL)(1METHYL4NITROPYRAZOL3YL)METHANONE
CC1=C(C(=NN1C(=O)C2=NN(C=C2(N+)(=O)(O))C)C)Br
Cn1nc(c(c1)(N+)(=O)(O))C(=O)n1nc(c(c1C)Br)C
InChI=1SC10H10BrN5O3c158(11)6(2)15(125)10(17)97(16(18)19)414(3)139h4H13H3
MFCD01417720
ZINC000000078642
ZINC00078642
ZINC78642

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.