Vitas-M small molecule compound
(5E)-5-[4-(benzyloxy)-3-ethoxy-5-(prop-2-en-1-yl)benzylidene]-1-(4-hydroxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL494985
SMILES CCOc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)O)cc(c1OCc1ccccc1)CC=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 C29H26N2O6 MW 498.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6/c1-3-8-21-15-20(17-25(36-4-2)26(21)37-18-19-9-6-5-7-10-19)16-24-27(33)30-29(35)31(28(24)34)22-11-13-23(32)14-12-22/h3,5-7,9-17,32H,1,4,8,18H2,2H3,(H,30,33,35)/b24-16+InChIKey
AAAQKSOQJMUHFH-LFVJCYFKSA-NSynonyms
(5E)5((3ETHOXY4PHENYLMETHOXY5PROP2ENYLPHENYL)METHYLIDENE)1(4HYDROXYPHENYL)13DIAZINANE246TRIONE
(5E)5(4(benzyloxy)3ethoxy5(prop2en1yl)benzylidene)1(4hydroxyphenyl)pyrimidine246(1H3H5H)trione
CCOC1=CC(=CC(=C1OCC2=CC=CC=C2)CC=C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)O
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)O)cc(c1OCc1ccccc1)CC=C
InChI=1SC29H26N2O6c138211520(1725(3642)26(21)37181996571019)162427(33)3029(35)31(28(24)34)22111323(32)141222h35791732H14818H22H3(H303335)b2416+
MFCD03993989
ZINC000016265309
ZINC16265309
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