Vitas-M small molecule compound
methyl 3-{[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}propanoate
Catalog ID
STK831144
SMILES COC(=O)CCSc1nc2sc3c(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 C19H24N2O4S2 MW 408.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N2O4S2/c1-11(2)9-21-17(23)15-12-8-19(3,4)25-10-13(12)27-16(15)20-18(21)26-7-6-14(22)24-5/h1,6-10H2,2-5H3InChIKey
PSWWYXKRLRSSPB-UHFFFAOYSA-NSynonyms
351008-25-8351008258
CC(=C)CN1C(=O)C2=C(N=C1SCCC(=O)OC)SC3=C2CC(OC3)(C)C
InChI=1SC19H24N2O4S2c111(2)92117(23)1512819(34)251013(12)2716(15)2018(21)267614(22)245h1610H225H3
methyl3((66dimethyl3(2methylallyl)4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)propanoate
methyl3((66dimethyl3(2methylprop2en1yl)4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)propanoate
methyl3((66dimethyl3(2methylprop2enyl)4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)propanoate
MFCD01875328
ZINC000000715982
ZINC00715982
ZINC715982
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