Vitas-M small molecule compound
ethyl (3-cyclohexyl-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl)acetate
Catalog ID
STL477349
SMILES CCOC(=O)Cn1c(=O)n(C2CCCCC2)c(=O)c2c1sc1c2CC(OC1)(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 C21H28N2O5S MW 420.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O5S/c1-4-27-16(24)11-22-19-17(14-10-21(2,3)28-12-15(14)29-19)18(25)23(20(22)26)13-8-6-5-7-9-13/h13H,4-12H2,1-3H3InChIKey
JKENOQPOQHFHCC-UHFFFAOYSA-NSynonyms
CCOC(=O)CN1C2=C(C3=C(S2)COC(C3)(C)C)C(=O)N(C1=O)C4CCCCC4
ethyl(3cyclohexyl66dimethyl24dioxo3458tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin1(6H)yl)acetate
ethyl2(3cyclohexyl66dimethyl24dioxo58dihydropyrano(23)thieno(24b)pyrimidin1yl)acetate
InChI=1SC21H28N2O5Sc142716(24)11221917(141021(23)281215(14)2919)18(25)23(20(22)26)138657913h13H412H213H3
MFCD07756263
ZINC000005274489
ZINC05274489
ZINC5274489
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