Vitas-M small molecule compound
2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-nitrobenzonitrile
Catalog ID
STK347703
SMILES N#Cc1cc(ccc1n1nc(cc1C)C)[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 C12H10N4O2 MW 242.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O2/c1-8-5-9(2)15(14-8)12-4-3-11(16(17)18)6-10(12)7-13/h3-6H,1-2H3InChIKey
XLSRSLZQXAFDDJ-UHFFFAOYSA-NSynonyms
955585-07-62(35dimethyl1Hpyrazol1yl)5nitrobenzonitrile
2(35DIMETHYLPYRAZOL1YL)5NITROBENZONITRILE
2(35DIMETHYLPYRAZOLYL)5NITROBENZENECARBONITRILE
955585076
CC1=CC(=NN1C2=C(C=C(C=C2)(N+)(=O)(O))C#N)C
InChI=1SC12H10N4O2c1859(2)15(148)124311(16(17)18)610(12)713h36H12H3
MFCD08559010
N#Cc1cc(ccc1n1nc(cc1C)C)(N+)(=O)(O)
ZINC000008731126
ZINC08731126
ZINC8731126
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