Vitas-M small molecule compound

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

Catalog ID
STK644152
SMILES COc1cc(ccc1OC)c1nn2c(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/c1-24-13-5-3-11(7-15(13)25-2)18-22-23-17(20-21-19(23)29-18)9-26-12-4-6-14-16(8-12)28-10-27-14/h3-8H,9-10H2,1-2H3
InChIKey
DHJIXBQQLSYICJ-UHFFFAOYSA-N
Synonyms
1081137-59-8
1081137598
3((13benzodioxol5yloxy)methyl)6(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
3((benzo(d)(13)dioxol5yloxy)methyl)6(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yloxymethyl)6(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
COC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)COC4=CC5=C(C=C4)OCO5)OC
InChI=1SC19H16N4O5Sc124135311(715(13)252)18222317(202119(23)2918)92612461416(812)28102714h38H910H212H3
MFCD12206210
ZINC000020720780
ZINC20720780

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Available files

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