Vitas-M small molecule compound

3-bromo-6-(4-nitro-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidin-2(1H)-one

Catalog ID
STK783541
SMILES [O-][N+](=O)c1c[nH]nc1c1cnc2n(c1)[nH]c(=O)c2Br

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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 C9H5BrN6O3 MW 325.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H5BrN6O3/c10-6-8-11-1-4(3-15(8)14-9(6)17)7-5(16(18)19)2-12-13-7/h1-3H,(H,12,13)(H,14,17)
InChIKey
GPUSMPJXAIFKFV-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1c(nH)nc1c1cnc2n(c1)(nH)c(=O)c2Br
3bromo6(4nitro1Hpyrazol3yl)pyrazolo(15a)pyrimidin2(1H)one
3BROMO6(4NITRO1HPYRAZOL5YL)1HPYRAZOLO(15A)PYRIMIDIN2ONE
3BROMO6(4NITROPYRAZOL3YL)8HYDRO3PYRAZOLINO(23A)PYRIMIDIN2ONE
C1=C(C=NC2=C(C(=O)NN21)Br)C3=C(C=NN3)(N+)(=O)(O)
InChI=1SC9H5BrN6O3c10681114(315(8)149(6)17)75(16(18)19)212137h13H(H1213)(H1417)
MFCD01115960
ZINC000004343613
ZINC04343613
ZINC4343613

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Available files

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