Vitas-M small molecule compound
benzyl {[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}acetate
Catalog ID
STK613350
SMILES O=C(CSC1=NC2C(N1c1ccc3c(c1)OCCO3)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 C22H22N2O6S2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O6S2/c25-21(30-11-15-4-2-1-3-5-15)12-31-22-23-17-13-32(26,27)14-18(17)24(22)16-6-7-19-20(10-16)29-9-8-28-19/h1-7,10,17-18H,8-9,11-14H2InChIKey
MVWRPVRKESNRJK-UHFFFAOYSA-NSynonyms
903867-10-7903867107
benzyl((1(23dihydro14benzodioxin6yl)55dioxido3a466atetrahydro1Hthieno(34d)imidazol2yl)sulfanyl)acetate
benzyl2((1(23dihydrobenzo(b)(14)dioxin6yl)55dioxido3a466atetrahydro1Hthieno(34d)imidazol2yl)thio)acetate
benzyl2((3(23dihydro14benzodioxin6yl)55dioxo3a466atetrahydrothieno(34d)imidazol2yl)sulfanyl)acetate
C1COC2=C(O1)C=CC(=C2)N3C4CS(=O)(=O)CC4N=C3SCC(=O)OCC5=CC=CC=C5
InChI=1SC22H22N2O6S2c2521(3011154213515)12312223171332(2627)1418(17)24(22)16671920(1016)29982819h17101718H891114H2
MFCD08290573
ZINC000009410573
ZINC000009410988
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