Vitas-M small molecule compound
3-[(1,3-benzodioxol-5-yloxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazole
Catalog ID
STL118159
SMILES COc1cc(cc(c1OC)OC)c1cn2c(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 C21H19N3O6S MW 441.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6S/c1-25-16-6-12(7-17(26-2)20(16)27-3)18-9-24-19(22-23-21(24)31-18)10-28-13-4-5-14-15(8-13)30-11-29-14/h4-9H,10-11H2,1-3H3InChIKey
LEQUOIZWGBIFHN-UHFFFAOYSA-NSynonyms
3((13benzodioxol5yloxy)methyl)6(345trimethoxyphenyl)(13)thiazolo(23c)(124)triazole
3(13benzodioxol5yloxymethyl)6(345trimethoxyphenyl)(13)thiazolo(23c)(124)triazole
COC1=CC(=CC(=C1OC)OC)C2=CN3C(=NN=C3S2)COC4=CC5=C(C=C4)OCO5
InChI=1SC21H19N3O6Sc12516612(717(262)20(16)273)1892419(222321(24)3118)102813451415(813)30112914h49H1011H213H3
MFCD14280090
ZINC000045221618
ZINC45221618
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