Vitas-M small molecule compound

2-[(4-nitro-1H-pyrazol-1-yl)methyl][1,2,4]triazolo[1,5-c]quinazoline

Catalog ID
STL398557
SMILES [O-][N+](=O)c1cnn(c1)Cc1nn2c(n1)c1ccccc1nc2

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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 C13H9N7O2 MW 295.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N7O2/c21-20(22)9-5-15-18(6-9)7-12-16-13-10-3-1-2-4-11(10)14-8-19(13)17-12/h1-6,8H,7H2
InChIKey
NREPGUDJRYDKKB-UHFFFAOYSA-N
Synonyms
1005687-10-4
(O)(N+)(=O)c1cnn(c1)Cc1nn2c(n1)c1ccccc1nc2
1005687104
2((4NITRO1HPYRAZOL1YL)METHYL)(124)TRIAZOLO(15C)QUINAZOLINE
2((4nitropyrazol1yl)methyl)(124)triazolo(15c)quinazoline
C1=CC=C2C(=C1)C3=NC(=NN3C=N2)CN4C=C(C=N4)(N+)(=O)(O)
InChI=1SC13H9N7O2c2120(22)951518(69)712161310312411(10)14819(13)1712h168H7H2
MFCD04136464
ZINC000002806555
ZINC02806555
ZINC2806555

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Available files

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