Vitas-M small molecule compound
(5E)-5-{3-ethoxy-4-[(3-fluorobenzyl)oxy]benzylidene}-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175238
SMILES CCOc1cc(ccc1OCc1cccc(c1)F)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)CC
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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 C28H25FN2O5 MW 488.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN2O5/c1-3-18-8-11-22(12-9-18)31-27(33)23(26(32)30-28(31)34)15-19-10-13-24(25(16-19)35-4-2)36-17-20-6-5-7-21(29)14-20/h5-16H,3-4,17H2,1-2H3,(H,30,32,34)/b23-15+InChIKey
AUKRTYHZUJRGBK-HZHRSRAPSA-NSynonyms
(5E)5((3ETHOXY4((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5(3ETHOXY4((3FLUOROBENZYL)OXY)BENZYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)OCC)C(=O)NC2=O
CCOc1cc(ccc1OCc1cccc(c1)F)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)CC
InChI=1SC28H25FN2O5c131881122(12918)3127(33)23(26(32)3028(31)34)1519101324(25(1619)3542)36172065721(29)1420h516H3417H212H3(H303234)b2315+
MFCD04529684
ZINC000001161744
ZINC01161744
ZINC1161744
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