Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-(1-benzyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole
Catalog ID
STK784851
SMILES [O-][N+](=O)c1nn(c(c1)c1onc(n1)c1ccc2c(c1)OCO2)Cc1ccccc1
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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 C19H13N5O5 MW 391.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N5O5/c25-24(26)17-9-14(23(21-17)10-12-4-2-1-3-5-12)19-20-18(22-29-19)13-6-7-15-16(8-13)28-11-27-15/h1-9H,10-11H2InChIKey
OYIAITLQBGQPSG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1nn(c(c1)c1onc(n1)c1ccc2c(c1)OCO2)Cc1ccccc1
3(13benzodioxol5yl)5(1benzyl3nitro1Hpyrazol5yl)124oxadiazole
3(13BENZODIOXOL5YL)5(2BENZYL5NITROPYRAZOL3YL)124OXADIAZOLE
C1OC2=C(O1)C=C(C=C2)C3=NOC(=N3)C4=CC(=NN4CC5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC19H13N5O5c2524(26)17914(23(2117)10124213512)192018(222919)13671516(813)28112715h19H1011H2
MFCD07657208
ZINC000004772074
ZINC04772074
ZINC4772074
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