Vitas-M small molecule compound
4-chloro-N-(2-methoxybenzyl)-3-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STK316826
SMILES COc1ccccc1CNC(=O)c1[nH]nc(c1Cl)[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 C12H11ClN4O4 MW 310.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClN4O4/c1-21-8-5-3-2-4-7(8)6-14-12(18)10-9(13)11(16-15-10)17(19)20/h2-5H,6H2,1H3,(H,14,18)(H,15,16)InChIKey
QTEHBCKRJVZBLZ-UHFFFAOYSA-NSynonyms
1046144-25-51046144255
1HPYRAZOLE3CARBOXAMIDE4CHLORO5NITRON(2METHOXYBENZYL)
4CHLORON((2METHOXYPHENYL)METHYL)3NITRO1HPYRAZOLE5CARBOXAMIDE
4chloroN(2methoxybenzyl)3nitro1Hpyrazole5carboxamide
COC1=CC=CC=C1CNC(=O)C2=C(C(=NN2)(N+)(=O)(O))Cl
COc1ccccc1CNC(=O)c1(nH)nc(c1Cl)(N+)(=O)(O)
InChI=1SC12H11ClN4O4c121853247(8)61412(18)109(13)11(161510)17(19)20h25H6H21H3(H1418)(H1516)
MFCD06197470
ZINC000012649303
ZINC12649303
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