Vitas-M small molecule compound
(5Z)-1-(4-bromo-3-methylphenyl)-5-(2,3-dibromo-4-hydroxy-5-methoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170347
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(c(c2)C)Br)c(c(c1O)Br)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 C19H13Br3N2O5 MW 589.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Br3N2O5/c1-8-5-10(3-4-12(8)20)24-18(27)11(17(26)23-19(24)28)6-9-7-13(29-2)16(25)15(22)14(9)21/h3-7,25H,1-2H3,(H,23,26,28)/b11-6-InChIKey
JAAKLSDECJOXAX-WDZFZDKYSA-NSynonyms
(5Z)1(4BROMO3METHYLPHENYL)5((23DIBROMO4HYDROXY5METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4BROMO3METHYLPHENYL)5(23DIBROMO4HYDROXY5METHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3Br)Br)O)OC)C(=O)NC2=O)Br
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(c(c2)C)Br)c(c(c1O)Br)Br
InChI=1SC19H13Br3N2O5c18510(3412(8)20)2418(27)11(17(26)2319(24)28)69713(292)16(25)15(22)14(9)21h3725H12H3(H232628)b116
MFCD02623688
ZINC000097960529
ZINC97960529
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