Vitas-M small molecule compound
(5E)-1-[2-(4-fluorophenyl)ethyl]-5-(2,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK533735
SMILES COc1cc(OC)c(cc1/C=C/1\C(=O)NC(=O)N(C1=O)CCc1ccc(cc1)F)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 C22H21FN2O6 MW 428.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN2O6/c1-29-17-12-19(31-3)18(30-2)11-14(17)10-16-20(26)24-22(28)25(21(16)27)9-8-13-4-6-15(23)7-5-13/h4-7,10-12H,8-9H2,1-3H3,(H,24,26,28)/b16-10+InChIKey
FQXJCSPLPHEHCQ-MHWRWJLKSA-NSynonyms
374540-82-6(5E)1(2(4FLUOROPHENYL)ETHYL)5((245TRIMETHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(2(4fluorophenyl)ethyl)5(245trimethoxybenzylidene)pyrimidine246(1H3H5H)trione
(E)1(4fluorophenethyl)5(245trimethoxybenzylidene)pyrimidine246(1H3H5H)trione
374540826
COC1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)CCC3=CC=C(C=C3)F)OC)OC
COc1cc(OC)c(cc1C=C1C(=O)NC(=O)N(C1=O)CCc1ccc(cc1)F)OC
InChI=1SC22H21FN2O6c129171219(313)18(302)1114(17)101620(26)2422(28)25(21(16)27)98134615(23)7513h471012H89H213H3(H242628)b1610+
MFCD01955606
ZINC000096699264
ZINC96699264
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