Vitas-M small molecule compound
(5Z)-5-{3-ethoxy-4-[(2-fluorobenzyl)oxy]benzylidene}-1-(4-hydroxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484504
SMILES CCOc1cc(ccc1OCc1ccccc1F)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
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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 C26H21FN2O6 MW 476.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O6/c1-2-34-23-14-16(7-12-22(23)35-15-17-5-3-4-6-21(17)27)13-20-24(31)28-26(33)29(25(20)32)18-8-10-19(30)11-9-18/h3-14,30H,2,15H2,1H3,(H,28,31,33)/b20-13-InChIKey
DCTIJHJFIGBAQT-MOSHPQCFSA-NSynonyms
(5Z)5((3ethoxy4((2fluorophenyl)methoxy)phenyl)methylidene)1(4hydroxyphenyl)13diazinane246trione
(5Z)5(3ethoxy4((2fluorobenzyl)oxy)benzylidene)1(4hydroxyphenyl)pyrimidine246(1H3H5H)trione
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O)OCC4=CC=CC=C4F
CCOc1cc(ccc1OCc1ccccc1F)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
InChI=1SC26H21FN2O6c1234231416(71222(23)351517534621(17)27)132024(31)2826(33)29(25(20)32)1881019(30)11918h31430H215H21H3(H283133)b2013
MFCD30713568
ZINC000033423824
ZINC33423824
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