Vitas-M small molecule compound

(5E)-1-(4-ethylphenyl)-5-{2-[(4-fluorobenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK175289
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)F)/C1=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 C26H21FN2O4 MW 444.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O4/c1-2-17-9-13-21(14-10-17)29-25(31)22(24(30)28-26(29)32)15-19-5-3-4-6-23(19)33-16-18-7-11-20(27)12-8-18/h3-15H,2,16H2,1H3,(H,28,30,32)/b22-15+
InChIKey
OILVBQIHJVFTEW-PXLXIMEGSA-N
Synonyms

(5E)1(4ETHYLPHENYL)5((2((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4ETHYLPHENYL)5(2((4FLUOROBENZYL)OXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3OCC4=CC=C(C=C4)F)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccc(cc2)F)C1=O
InChI=1SC26H21FN2O4c121791321(141017)2925(31)22(24(30)2826(29)32)1519534623(19)33161871120(27)12818h315H216H21H3(H283032)b2215+
MFCD04594223
ZINC000001160944
ZINC01160944
ZINC1160944

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Available files

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