Vitas-M small molecule compound
ethyl 4-{[2-amino-5-cyano-6-(methylsulfanyl)pyrimidin-4-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STK747089
SMILES CCOC(=O)CC(=O)CSc1nc(N)nc(c1C#N)SC
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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 C12H14N4O3S2 MW 326.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O3S2/c1-3-19-9(18)4-7(17)6-21-11-8(5-13)10(20-2)15-12(14)16-11/h3-4,6H2,1-2H3,(H2,14,15,16)InChIKey
LBKUEWJAXBFDHW-UHFFFAOYSA-NSynonyms
5790-19-25790192
CCOC(=O)CC(=O)CSC1=NC(=NC(=C1C#N)SC)N
ethyl4((2amino5cyano6(methylsulfanyl)pyrimidin4yl)sulfanyl)3oxobutanoate
ETHYL4(2AMINO5CYANO6METHYLSULFANYLPYRIMIDIN4YL)SULFANYL3OXOBUTANOATE
InChI=1SC12H14N4O3S2c13199(18)47(17)621118(513)10(202)1512(14)1611h346H212H3(H2141516)
MFCD00742016
ZINC000003087918
ZINC03087918
ZINC3087918
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