Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole
Catalog ID
STK783389
SMILES [O-][N+](=O)c1nn(c(c1)C)Cc1onc(n1)c1ccc2c(c1)OCO2
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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 C14H11N5O5 MW 329.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N5O5/c1-8-4-12(19(20)21)16-18(8)6-13-15-14(17-24-13)9-2-3-10-11(5-9)23-7-22-10/h2-5H,6-7H2,1H3InChIKey
DDDADRVKKVJVKS-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1nn(c(c1)C)Cc1onc(n1)c1ccc2c(c1)OCO2
3(13benzodioxol5yl)5((5methyl3nitro1Hpyrazol1yl)methyl)124oxadiazole
3(13BENZODIOXOL5YL)5((5METHYL3NITROPYRAZOL1YL)METHYL)124OXADIAZOLE
CC1=CC(=NN1CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)(N+)(=O)(O)
InChI=1SC14H11N5O5c18412(19(20)21)1618(8)6131514(172413)9231011(59)2372210h25H67H21H3
MFCD06618141
ZINC000004745691
ZINC04745691
ZINC4745691
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