Vitas-M small molecule compound
methyl [6,6-dimethyl-1-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Catalog ID
STK616557
SMILES COC(=O)Cn1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)CC(=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 C18H22N2O5S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5S/c1-10(2)7-20-16-14(11-6-18(3,4)25-9-12(11)26-16)15(22)19(17(20)23)8-13(21)24-5/h1,6-9H2,2-5H3InChIKey
BUGUJKGMGIRVDP-UHFFFAOYSA-NSynonyms
903204-06-8903204068
CC(=C)CN1C2=C(C3=C(S2)COC(C3)(C)C)C(=O)N(C1=O)CC(=O)OC
InChI=1SC18H22N2O5Sc110(2)7201614(11618(34)25912(11)2616)15(22)19(17(20)23)813(21)245h169H225H3
methyl(66dimethyl1(2methylprop2en1yl)24dioxo1568tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin3(4H)yl)acetate
methyl2(66dimethyl1(2methylallyl)24dioxo56dihydro1Hpyrano(4345)thieno(23d)pyrimidin3(2H4H8H)yl)acetate
methyl2(66dimethyl1(2methylprop2enyl)24dioxo58dihydropyrano(23)thieno(24b)pyrimidin3yl)acetate
MFCD08291609
ZINC000006760143
ZINC06760143
ZINC6760143
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