Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-2-{[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]sulfanyl}ethanone
Catalog ID
STK922465
SMILES O=C(c1ccc2c(c1)OCO2)CSc1nccc(n1)c1ccc2c(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 C20H14N2O5S MW 394.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O5S/c23-15(13-2-4-17-19(8-13)27-11-25-17)9-28-20-21-6-5-14(22-20)12-1-3-16-18(7-12)26-10-24-16/h1-8H,9-11H2InChIKey
XIDMHFRPDRUWIP-UHFFFAOYSA-NSynonyms
941252-57-91(13benzodioxol5yl)2((4(13benzodioxol5yl)pyrimidin2yl)sulfanyl)ethanone
1(13benzodioxol5yl)2(4(13benzodioxol5yl)pyrimidin2yl)sulfanylethanone
1(2HBENZO(34D)13DIOXOLEN5YL)2(4(2HBENZO(34D)13DIOXOLEN5YL)PYRIMIDIN2YLTHIO)ETHAN1ONE
1(BENZO(D)(13)DIOXOL5YL)2((4(BENZO(D)(13)DIOXOL5YL)PYRIMIDIN2YL)THIO)ETHANONE
941252579
C1OC2=C(O1)C=C(C=C2)C3=NC(=NC=C3)SCC(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC20H14N2O5Sc2315(13241719(813)27112517)92820216514(2220)12131618(712)26102416h18H911H2
MFCD09761148
ZINC000012249816
ZINC12249816
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