Vitas-M small molecule compound
benzyl {[1-(1,3-benzodioxol-5-yl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}acetate
Catalog ID
STK600725
SMILES O=C(CSC1=NC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2)OCc1ccccc1
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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 C21H20N2O6S2 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6S2/c24-20(27-9-14-4-2-1-3-5-14)10-30-21-22-16-11-31(25,26)12-17(16)23(21)15-6-7-18-19(8-15)29-13-28-18/h1-8,16-17H,9-13H2InChIKey
VPEUQBHPIFIQAY-UHFFFAOYSA-NSynonyms
903860-79-7903860797
benzyl((1(13benzodioxol5yl)55dioxido3a466atetrahydro1Hthieno(34d)imidazol2yl)sulfanyl)acetate
benzyl2((1(benzo(d)(13)dioxol5yl)55dioxido3a466atetrahydro1Hthieno(34d)imidazol2yl)thio)acetate
benzyl2((3(13benzodioxol5yl)55dioxo3a466atetrahydrothieno(34d)imidazol2yl)sulfanyl)acetate
C1C2C(CS1(=O)=O)N(C(=N2)SCC(=O)OCC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5
InChI=1SC21H20N2O6S2c2420(279144213514)10302122161131(2526)1217(16)23(21)15671819(815)29132818h181617H913H2
MFCD08291309
ZINC000009411024
ZINC000009411027
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