Vitas-M small molecule compound

N,1-dimethyl-4-nitro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazole-5-carboxamide

Catalog ID
STL395888
SMILES CN(C(=O)c1n(C)ncc1[N+](=O)[O-])Cc1c(C)nn(c1C)C

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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 C13H18N6O3 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N6O3/c1-8-10(9(2)17(4)15-8)7-16(3)13(20)12-11(19(21)22)6-14-18(12)5/h6H,7H2,1-5H3
InChIKey
GTEIGHSIFRLXDH-UHFFFAOYSA-N
Synonyms
1005626-70-9
CC1=C(C(=NN1C)C)CN(C)C(=O)C2=C(C=NN2C)(N+)(=O)(O)
CN(C(=O)c1n(C)ncc1(N+)(=O)(O))Cc1c(C)nn(c1C)C
N1DIMETHYL4NITRON((135TRIMETHYL1HPYRAZOL4YL)METHYL)1HPYRAZOLE5CARBOXAMIDE
N2DIMETHYL4NITRON((135TRIMETHYLPYRAZOL4YL)METHYL)PYRAZOLE3CARBOXAMIDE
Registry IDs
MFCD04043191
ZINC000002778916
ZINC02778916
ZINC2778916

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Available files

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