Vitas-M small molecule compound
2-methyl-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Catalog ID
STL402659
SMILES CC(C(=O)N1CCCC1)Cn1nc(cc1C)[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 C12H18N4O3 MW 266.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O3/c1-9(12(17)14-5-3-4-6-14)8-15-10(2)7-11(13-15)16(18)19/h7,9H,3-6,8H2,1-2H3InChIKey
BZEKDQKKEZDQAE-UHFFFAOYSA-NSynonyms
1005613-31-91005613319
2methyl3(5methyl3nitro1Hpyrazol1yl)1(pyrrolidin1yl)propan1one
2METHYL3(5METHYL3NITROPYRAZOL1YL)1PYRROLIDIN1YLPROPAN1ONE
CC(C(=O)N1CCCC1)Cn1nc(cc1C)(N+)(=O)(O)
CC1=CC(=NN1CC(C)C(=O)N2CCCC2)(N+)(=O)(O)
InChI=1SC12H18N4O3c19(12(17)14534614)81510(2)711(1315)16(18)19h79H368H212H3
MFCD04046338
ZINC000002787904
ZINC000002787905
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