Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-[3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
Catalog ID
STK783798
SMILES [O-][N+](=O)c1nn(c(c1)C)CCCc1onc(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 C16H15N5O5 MW 357.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O5/c1-10-7-14(21(22)23)18-20(10)6-2-3-15-17-16(19-26-15)11-4-5-12-13(8-11)25-9-24-12/h4-5,7-8H,2-3,6,9H2,1H3InChIKey
USTVDOVRTKBVQQ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1nn(c(c1)C)CCCc1onc(n1)c1ccc2c(c1)OCO2
3(13benzodioxol5yl)5(3(5methyl3nitro1Hpyrazol1yl)propyl)124oxadiazole
3(13BENZODIOXOL5YL)5(3(5METHYL3NITROPYRAZOL1YL)PROPYL)124OXADIAZOLE
CC1=CC(=NN1CCCC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)(N+)(=O)(O)
InChI=1SC16H15N5O5c110714(21(22)23)1820(10)623151716(192615)11451213(811)2592412h4578H2369H21H3
MFCD06618972
ZINC000004753329
ZINC04753329
ZINC4753329
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