Vitas-M small molecule compound
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
Catalog ID
STK775392
SMILES [O-][N+](=O)c1c(C)nn(c1C)Cc1onc(n1)c1ccc(cc1)n1cccc1
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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 C18H16N6O3 MW 364.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N6O3/c1-12-17(24(25)26)13(2)23(20-12)11-16-19-18(21-27-16)14-5-7-15(8-6-14)22-9-3-4-10-22/h3-10H,11H2,1-2H3InChIKey
VUXZAJXRKPQQMO-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1c(C)nn(c1C)Cc1onc(n1)c1ccc(cc1)n1cccc1
5((35dimethyl4nitro1Hpyrazol1yl)methyl)3(4(1Hpyrrol1yl)phenyl)124oxadiazole
5((35DIMETHYL4NITROPYRAZOL1YL)METHYL)3(4PYRROL1YLPHENYL)124OXADIAZOLE
CC1=C(C(=NN1CC2=NC(=NO2)C3=CC=C(C=C3)N4C=CC=C4)C)(N+)(=O)(O)
InChI=1SC18H16N6O3c11217(24(25)26)13(2)23(2012)11161918(212716)145715(8614)229341022h310H11H212H3
MFCD05257223
ZINC000004623094
ZINC04623094
ZINC4623094
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