Vitas-M small molecule compound
(5E)-5-(3,5-dibromo-4-hydroxybenzylidene)-1-(3,4-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK757346
SMILES O=C1NC(=S)N(C(=O)/C/1=C/c1cc(Br)c(c(c1)Br)O)c1ccc(c(c1)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 C19H14Br2N2O3S MW 510.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Br2N2O3S/c1-9-3-4-12(5-10(9)2)23-18(26)13(17(25)22-19(23)27)6-11-7-14(20)16(24)15(21)8-11/h3-8,24H,1-2H3,(H,22,25,27)/b13-6+InChIKey
JJNHDTZGKXLFPN-AWNIVKPZSA-NSynonyms
(5E)5((35DIBROMO4HYDROXYPHENYL)METHYLIDENE)1(34DIMETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(35dibromo4hydroxybenzylidene)1(34dimethylphenyl)2thioxodihydropyrimidine46(1H5H)dione
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)Br)C(=O)NC2=S)C
InChI=1SC19H14Br2N2O3Sc193412(510(9)2)2318(26)13(17(25)2219(23)27)611714(20)16(24)15(21)811h3824H12H3(H222527)b136+
MFCD01053112
O=C1NC(=S)N(C(=O)C1=Cc1cc(Br)c(c(c1)Br)O)c1ccc(c(c1)C)C
ZINC000000714676
ZINC00714676
ZINC714676
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