Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)benzylidene]-1-(2-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176743
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccccc2F)cc(c1O)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 C22H19FN2O5 MW 410.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN2O5/c1-3-7-14-10-13(12-18(19(14)26)30-4-2)11-15-20(27)24-22(29)25(21(15)28)17-9-6-5-8-16(17)23/h3,5-6,8-12,26H,1,4,7H2,2H3,(H,24,27,29)/b15-11-InChIKey
KKHPICHMMPQAPK-PTNGSMBKSA-NSynonyms
(5Z)5((3ETHOXY4HYDROXY5PROP2ENYLPHENYL)METHYLIDENE)1(2FLUOROPHENYL)13DIAZINANE246TRIONE
(5Z)5(3ETHOXY4HYDROXY5(PROP2EN1YL)BENZYLIDENE)1(2FLUOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3F
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccccc2F)cc(c1O)CC=C
InChI=1SC22H19FN2O5c137141013(1218(19(14)26)3042)111520(27)2422(29)25(21(15)28)17965816(17)23h35681226H147H22H3(H242729)b1511
MFCD02905072
ZINC000014011172
ZINC14011172
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