Vitas-M small molecule compound
(5E)-5-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-1-(4-bromo-2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK330905
SMILES CCOc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)c2ccc(cc2C)Br)cc(c1O)Br
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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 C20H16Br2N2O4S MW 540.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Br2N2O4S/c1-3-28-16-9-11(8-14(22)17(16)25)7-13-18(26)23-20(29)24(19(13)27)15-5-4-12(21)6-10(15)2/h4-9,25H,3H2,1-2H3,(H,23,26,29)/b13-7+InChIKey
OHODYMVJRHINFL-NTUHNPAUSA-NSynonyms
(5E)5((3bromo5ethoxy4hydroxyphenyl)methylidene)1(4bromo2methylphenyl)2sulfanylidene13diazinane46dione
(5E)5(3bromo5ethoxy4hydroxybenzylidene)1(4bromo2methylphenyl)2thioxodihydropyrimidine46(1H5H)dione
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)Br)C)Br)O
CCOc1cc(C=C2C(=O)NC(=S)N(C2=O)c2ccc(cc2C)Br)cc(c1O)Br
InChI=1SC20H16Br2N2O4Sc132816911(814(22)17(16)25)71318(26)2320(29)24(19(13)27)155412(21)610(15)2h4925H3H212H3(H232629)b137+
MFCD03175626
ZINC000097962645
ZINC97962645
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