Vitas-M small molecule compound

N-(2-methoxy-4-nitrophenyl)-1,3-dimethyl-1H-pyrazole-4-carboxamide

Catalog ID
STK316592
SMILES COc1cc(ccc1NC(=O)c1cn(nc1C)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 C13H14N4O4 MW 290.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O4/c1-8-10(7-16(2)15-8)13(18)14-11-5-4-9(17(19)20)6-12(11)21-3/h4-7H,1-3H3,(H,14,18)
InChIKey
JTCSSKGEYVSTQU-UHFFFAOYSA-N
Synonyms
514857-11-5
514857115
CC1=NN(C=C1C(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))OC)C
COc1cc(ccc1NC(=O)c1cn(nc1C)C)(N+)(=O)(O)
InChI=1SC13H14N4O4c1810(716(2)158)13(18)1411549(17(19)20)612(11)213h47H13H3(H1418)
MFCD03071255
N(2methoxy4nitrophenyl)13dimethyl1Hpyrazole4carboxamide
N(2METHOXY4NITROPHENYL)13DIMETHYLPYRAZOLE4CARBOXAMIDE
N(4NITRO2METHOXYPHENYL)13DIMETHYL1HPYRAZOLE4CARBOXAMIDE
ZINC000005792419
ZINC05792419
ZINC5792419

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.