Vitas-M small molecule compound
(5E)-1-(4-fluorobenzyl)-5-(3,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK763643
SMILES COc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)Cc2ccc(cc2)F)cc(c1OC)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 C21H19FN2O6 MW 414.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN2O6/c1-28-16-9-13(10-17(29-2)18(16)30-3)8-15-19(25)23-21(27)24(20(15)26)11-12-4-6-14(22)7-5-12/h4-10H,11H2,1-3H3,(H,23,25,27)/b15-8+InChIKey
NZFHTYHKCVCZCY-OVCLIPMQSA-NSynonyms
(5E)1((4FLUOROPHENYL)METHYL)5((345TRIMETHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4fluorobenzyl)5(345trimethoxybenzylidene)pyrimidine246(1H3H5H)trione
(Z)1(4fluorobenzyl)5(345trimethoxybenzylidene)pyrimidine246(1H3H5H)trione
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=C(C=C3)F
COc1cc(C=C2C(=O)NC(=O)N(C2=O)Cc2ccc(cc2)F)cc(c1OC)OC
InChI=1SC21H19FN2O6c12816913(1017(292)18(16)303)81519(25)2321(27)24(20(15)26)11124614(22)7512h410H11H213H3(H232527)b158+
MFCD01896020
ZINC000009332797
ZINC9332797
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