Vitas-M small molecule compound
ethyl 4-{[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STL079606
SMILES CCOC(=O)CC(=O)CSc1nc2sc(c(c2c(=O)n1CC=C)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 C17H20N2O4S2 MW 380.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S2/c1-5-7-19-16(22)14-10(3)11(4)25-15(14)18-17(19)24-9-12(20)8-13(21)23-6-2/h5H,1,6-9H2,2-4H3InChIKey
XPXWPHDJZWFAIH-UHFFFAOYSA-NSynonyms
328018-10-6328018106
CCOC(=O)CC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC=C
ETHYL4((3ALLYL56DIMETHYL4OXO34DIHYDROTHIENO(23D)PYRIMIDIN2YL)THIO)3OXOBUTANOATE
ethyl4((56dimethyl4oxo3(prop2en1yl)34dihydrothieno(23d)pyrimidin2yl)sulfanyl)3oxobutanoate
ETHYL4(56DIMETHYL4OXO3PROP2ENYL(3HYDROTHIOPHENO(23D)PYRIMIDIN2YLTHIO))3OXOBUTANOATE
ETHYL4(56DIMETHYL4OXO3PROP2ENYLTHIENO(23D)PYRIMIDIN2YL)SULFANYL3OXOBUTANOATE
InChI=1SC17H20N2O4S2c1571916(22)1410(3)11(4)2515(14)1817(19)24912(20)813(21)2362h5H169H224H3
MFCD02659939
ZINC000002684817
ZINC02684817
ZINC2684817
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