Vitas-M small molecule compound

3-(1,3-benzodioxol-5-yl)-5-(3,4-dimethoxybenzyl)-1,2,4-oxadiazole

Catalog ID
STK687133
SMILES COc1cc(ccc1OC)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 C18H16N2O5 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5/c1-21-13-5-3-11(7-15(13)22-2)8-17-19-18(20-25-17)12-4-6-14-16(9-12)24-10-23-14/h3-7,9H,8,10H2,1-2H3
InChIKey
WPKBJDPASVKFAR-UHFFFAOYSA-N
Synonyms
885002-77-7
124OXADIAZOLE3(13BENZODIOXOL5YL)5((34DIMETHOXYPHENYL)METHYL)
3(13BENZODIOXOL5YL)5((34DIMETHOXYPHENYL)METHYL)124OXADIAZOLE
3(13benzodioxol5yl)5(34dimethoxybenzyl)124oxadiazole
885002777
COC1=C(C=C(C=C1)CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)OC
InChI=1SC18H16N2O5c121135311(715(13)222)8171918(202517)12461416(912)24102314h379H810H212H3
MFCD06617527
ZINC000004744870
ZINC04744870
ZINC4744870

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Available files

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