Vitas-M small molecule compound

4-{5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridine

Catalog ID
STK775388
SMILES [O-][N+](=O)c1c(C)nn(c1C)Cc1onc(n1)c1ccncc1

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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 C13H12N6O3 MW 300.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N6O3/c1-8-12(19(20)21)9(2)18(16-8)7-11-15-13(17-22-11)10-3-5-14-6-4-10/h3-6H,7H2,1-2H3
InChIKey
WVESJKZMGVHFRZ-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1c(C)nn(c1C)Cc1onc(n1)c1ccncc1
4(5((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)124OXADIAZOL3YL)PYRIDINE
5((35DIMETHYL4NITROPYRAZOL1YL)METHYL)3PYRIDIN4YL124OXADIAZOLE
CC1=C(C(=NN1CC2=NC(=NO2)C3=CC=NC=C3)C)(N+)(=O)(O)
InChI=1SC13H12N6O3c1812(19(20)21)9(2)18(168)7111513(172211)1035146410h36H7H212H3
MFCD05257219
ZINC000001422151
ZINC01422151
ZINC1422151

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Available files

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