Vitas-M small molecule compound
(5E)-1-(4-bromo-3-methylphenyl)-5-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170892
SMILES C=CCc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(c(c2)C)Br)cc(c1O)OC
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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 C22H19BrN2O5 MW 471.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O5/c1-4-5-14-9-13(11-18(30-3)19(14)26)10-16-20(27)24-22(29)25(21(16)28)15-6-7-17(23)12(2)8-15/h4,6-11,26H,1,5H2,2-3H3,(H,24,27,29)/b16-10+InChIKey
MIBWDRCSXAMZQT-MHWRWJLKSA-NSynonyms
(5E)1(4BROMO3METHYLPHENYL)5((4HYDROXY3METHOXY5PROP2ENYLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMO3METHYLPHENYL)5(4HYDROXY3METHOXY5(PROP2EN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
C=CCc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(c(c2)C)Br)cc(c1O)OC
CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)CC=C)C(=O)NC2=O)Br
InChI=1SC22H19BrN2O5c14514913(1118(303)19(14)26)101620(27)2422(29)25(21(16)28)156717(23)12(2)815h461126H15H223H3(H242729)b1610+
MFCD02193459
ZINC000001211752
ZINC01211752
ZINC1211752
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