Vitas-M small molecule compound

3-methoxy-N-(2-methoxy-5-nitrophenyl)-4-nitro-1H-pyrazole-5-carboxamide

Catalog ID
STK316994
SMILES COc1ccc(cc1NC(=O)c1[nH]nc(c1[N+](=O)[O-])OC)[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 C12H11N5O7 MW 337.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O7/c1-23-8-4-3-6(16(19)20)5-7(8)13-11(18)9-10(17(21)22)12(24-2)15-14-9/h3-5H,1-2H3,(H,13,18)(H,14,15)
InChIKey
CFHBIBYGHAEHMD-UHFFFAOYSA-N
Synonyms
515176-75-7
3methoxyN(2methoxy5nitrophenyl)4nitro1Hpyrazole5carboxamide
4NITRON(5NITRO2METHOXYPHENYL)3METHOXY1HPYRAZOLE5CARBOXAMIDE
515176757
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C2=C(C(=NN2)OC)(N+)(=O)(O)
COc1ccc(cc1NC(=O)c1(nH)nc(c1(N+)(=O)(O))OC)(N+)(=O)(O)
InChI=1SC12H11N5O7c1238436(16(19)20)57(8)1311(18)910(17(21)22)12(242)15149h35H12H3(H1318)(H1415)
MFCD03758586
ZINC000012649435
ZINC12649435

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Available files

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