Vitas-M small molecule compound
2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL401007
SMILES COc1nn(cc1[N+](=O)[O-])CCc1nn2c(n1)c1cnn(c1nc2)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 C13H13N9O3 MW 343.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N9O3/c1-19-11-8(5-15-19)12-16-10(17-21(12)7-14-11)3-4-20-6-9(22(23)24)13(18-20)25-2/h5-7H,3-4H2,1-2H3InChIKey
VYEYTNGDIYSKDN-UHFFFAOYSA-NSynonyms
1005602-80-11005602801
2(2(3methoxy4nitro1Hpyrazol1yl)ethyl)7methyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
CN1C2=C(C=N1)C3=NC(=NN3C=N2)CCN4C=C(C(=N4)OC)(N+)(=O)(O)
COc1nn(cc1(N+)(=O)(O))CCc1nn2c(n1)c1cnn(c1nc2)C
InChI=1SC13H13N9O3c119118(51519)121610(1721(12)71411)342069(22(23)24)13(1820)252h57H34H212H3
MFCD04053377
ZINC000002802407
ZINC02802407
ZINC2802407
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