Vitas-M small molecule compound
3-(4-ethylphenyl)-6-hydroxy-5-[(E)-{[2-(methylsulfanyl)phenyl]imino}methyl]-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STK135342
SMILES CCc1ccc(cc1)n1c(=S)[nH]c(c(c1=O)/C=N/c1ccccc1SC)O
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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 C20H19N3O2S2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O2S2/c1-3-13-8-10-14(11-9-13)23-19(25)15(18(24)22-20(23)26)12-21-16-6-4-5-7-17(16)27-2/h4-12,24H,3H2,1-2H3,(H,22,26)/b21-12+InChIKey
QBPCYCKFCGYZNV-CIAFOILYSA-NSynonyms
3(4ethylphenyl)6hydroxy5((E)((2(methylsulfanyl)phenyl)imino)methyl)2thioxo23dihydropyrimidin4(1H)one
CCc1ccc(cc1)n1c(=S)(nH)c(c(c1=O)C=Nc1ccccc1SC)O
MFCD08679253
ZINC000101591192
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