Vitas-M small molecule compound
(5Z)-1-(3-chloro-4-methoxyphenyl)-5-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK039216
SMILES C=CCc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(c(c2)Cl)OC)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 C22H19ClN2O6 MW 442.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O6/c1-4-5-13-8-12(10-18(31-3)19(13)26)9-15-20(27)24-22(29)25(21(15)28)14-6-7-17(30-2)16(23)11-14/h4,6-11,26H,1,5H2,2-3H3,(H,24,27,29)/b15-9-InChIKey
HLDXSQDLEKOCEK-DHDCSXOGSA-NSynonyms
732248-15-6(5Z)1(3CHLORO4METHOXYPHENYL)5((4HYDROXY3METHOXY5PROP2ENYLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3CHLORO4METHOXYPHENYL)5(4HYDROXY3METHOXY5(PROP2EN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(Z)5(3allyl4hydroxy5methoxybenzylidene)1(3chloro4methoxyphenyl)pyrimidine246(1H3H5H)trione
732248156
C=CCc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(c(c2)Cl)OC)cc(c1O)OC
COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)CC=C)C(=O)NC2=O)Cl
InChI=1SC22H19ClN2O6c14513812(1018(313)19(13)26)91520(27)2422(29)25(21(15)28)146717(302)16(23)1114h461126H15H223H3(H242729)b159
MFCD03680525
STK039216
ZINC000009428418
ZINC09428418
ZINC9428418
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.