Vitas-M small molecule compound
hexyl {[6,6-dimethyl-3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK525251
SMILES CCCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1CC(=C)C)CC(OC3)(C)C
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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 C23H32N2O4S2 MW 464.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N2O4S2/c1-6-7-8-9-10-28-18(26)14-30-22-24-20-19(21(27)25(22)12-15(2)3)16-11-23(4,5)29-13-17(16)31-20/h2,6-14H2,1,3-5H3InChIKey
JQJKEKLVIFDVBX-UHFFFAOYSA-NSynonyms
371928-03-9371928039
CCCCCCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC(=C)C
hexyl((66dimethyl3(2methylprop2en1yl)4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
hexyl2((66dimethyl3(2methylallyl)4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
hexyl2((66dimethyl3(2methylprop2enyl)4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
InChI=1SC23H32N2O4S2c16789102818(26)143022242019(21(27)25(22)1215(2)3)161123(45)291317(16)3120h2614H2135H3
MFCD01561391
ZINC000013756260
ZINC13756260
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