Vitas-M small molecule compound
methyl {[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
STK830019
SMILES COC(=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 C18H22N2O4S2 MW 394.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O4S2/c1-10(2)7-20-16(22)14-11-6-18(3,4)24-8-12(11)26-15(14)19-17(20)25-9-13(21)23-5/h1,6-9H2,2-5H3InChIKey
VWHKMIMNGUMZLO-UHFFFAOYSA-NSynonyms
351007-22-2351007222
CC(=C)CN1C(=O)C2=C(N=C1SCC(=O)OC)SC3=C2CC(OC3)(C)C
InChI=1SC18H22N2O4S2c110(2)72016(22)1411618(34)24812(11)2615(14)1917(20)25913(21)235h169H225H3
methyl((66dimethyl3(2methylprop2en1yl)4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((66dimethyl3(2methylallyl)4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
methyl2((66dimethyl3(2methylprop2enyl)4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
MFCD01562430
ZINC000000870366
ZINC00870366
ZINC870366
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