Vitas-M small molecule compound

7-methyl-2-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STL403166
SMILES CC(c1nn2c(n1)c1cnn(c1nc2)C)Cn1ncc(c1)[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 C13H13N9O2 MW 327.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N9O2/c1-8(5-20-6-9(3-16-20)22(23)24)11-17-13-10-4-15-19(2)12(10)14-7-21(13)18-11/h3-4,6-8H,5H2,1-2H3
InChIKey
MXYRTNYOPWATSS-UHFFFAOYSA-N
Synonyms
1005704-16-4
1005704164
7methyl2(1(4nitro1Hpyrazol1yl)propan2yl)7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
CC(c1nn2c(n1)c1cnn(c1nc2)C)Cn1ncc(c1)(N+)(=O)(O)
CC(CN1C=C(C=N1)(N+)(=O)(O))C2=NN3C=NC4=C(C3=N2)C=NN4C
InChI=1SC13H13N9O2c18(52069(31620)22(23)24)1117131041519(2)12(10)14721(13)1811h3468H5H212H3
MFCD04053318
ZINC000002802263
ZINC000002802264

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Available files

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