Vitas-M small molecule compound

3-[(1,3-benzodioxol-5-yloxy)methyl]-6-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK644302
SMILES COc1ccc(cc1)OCc1nn2c(s1)nnc2COc1ccc2c(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 C19H16N4O5S MW 412.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O5S/c1-24-12-2-4-13(5-3-12)26-10-18-22-23-17(20-21-19(23)29-18)9-25-14-6-7-15-16(8-14)28-11-27-15/h2-8H,9-11H2,1H3
InChIKey
XDSOEIYGYDZEKL-UHFFFAOYSA-N
Synonyms
1081148-97-1
1081148971
3((13benzodioxol5yloxy)methyl)6((4methoxyphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
3((benzo(d)(13)dioxol5yloxy)methyl)6((4methoxyphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yloxymethyl)6((4methoxyphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)COC4=CC5=C(C=C4)OCO5
InChI=1SC19H16N4O5Sc124122413(5312)261018222317(202119(23)2918)92514671516(814)28112715h28H911H21H3
MFCD12205556
ZINC000020716580
ZINC20716580

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Available files

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