Vitas-M small molecule compound
(5Z)-1-(2-chlorophenyl)-5-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484380
SMILES COc1cc(ccc1OCc1ccccc1F)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1Cl
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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 C25H18ClFN2O5 MW 480.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFN2O5/c1-33-22-13-15(10-11-21(22)34-14-16-6-2-4-8-19(16)27)12-17-23(30)28-25(32)29(24(17)31)20-9-5-3-7-18(20)26/h2-13H,14H2,1H3,(H,28,30,32)/b17-12-InChIKey
WNZDTFQELGGFMY-ATVHPVEESA-NSynonyms
(5Z)1(2chlorophenyl)5((4((2fluorophenyl)methoxy)3methoxyphenyl)methylidene)13diazinane246trione
(5Z)1(2chlorophenyl)5(4((2fluorobenzyl)oxy)3methoxybenzylidene)pyrimidine246(1H3H5H)trione
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3Cl)OCC4=CC=CC=C4F
COc1cc(ccc1OCc1ccccc1F)C=C1C(=O)NC(=O)N(C1=O)c1ccccc1Cl
InChI=1SC25H18ClFN2O5c133221315(101121(22)341416624819(16)27)121723(30)2825(32)29(24(17)31)20953718(20)26h213H14H21H3(H283032)b1712
MFCD30713471
ZINC000033424061
ZINC33424061
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