Vitas-M small molecule compound
2-{[3-(3,5-difluorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL076780
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nc2ccsc2c(=O)n1c1cc(F)cc(c1)F
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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 C22H15F2N3O4S2 MW 487.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15F2N3O4S2/c23-12-7-13(24)9-15(8-12)27-21(29)20-16(3-6-32-20)26-22(27)33-11-19(28)25-14-1-2-17-18(10-14)31-5-4-30-17/h1-3,6-10H,4-5,11H2,(H,25,28)InChIKey
XMRKTTLYIJOIIN-UHFFFAOYSA-NSynonyms
2((3(35difluorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2(3(35difluorophenyl)4oxothieno(32d)pyrimidin2yl)sulfanylN(23dihydro14benzodioxin6yl)acetamide
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC(=CC(=C5)F)F)SC=C4
InChI=1SC22H15F2N3O4S2c2312713(24)915(812)2721(29)2016(363220)2622(27)331119(28)2514121718(1014)31543017h13610H4511H2(H2528)
MFCD18198012
ZINC000067217694
ZINC67217694
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