Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STK785587
SMILES O=C(c1cc(nn1C)[N+](=O)[O-])Nc1ccc2c(c1)OCO2
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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 C12H10N4O5 MW 290.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O5/c1-15-8(5-11(14-15)16(18)19)12(17)13-7-2-3-9-10(4-7)21-6-20-9/h2-5H,6H2,1H3,(H,13,17)InChIKey
KJWVFPFMRWKMLZ-UHFFFAOYSA-NSynonyms
CN1C(=CC(=N1)(N+)(=O)(O))C(=O)NC2=CC3=C(C=C2)OCO3
InChI=1SC12H10N4O5c1158(511(1415)16(18)19)12(17)13723910(47)216209h25H6H21H3(H1317)
MFCD07800045
N(13benzodioxol5yl)1methyl3nitro1Hpyrazole5carboxamide
N(13BENZODIOXOL5YL)2METHYL5NITROPYRAZOLE3CARBOXAMIDE
O=C(c1cc(nn1C)(N+)(=O)(O))Nc1ccc2c(c1)OCO2
ZINC000004785053
ZINC04785053
ZINC4785053
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