Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK035517
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
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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 C25H18BrClN2O5 MW 541.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrClN2O5/c1-33-22-13-16(4-11-21(22)34-14-15-2-7-18(27)8-3-15)12-20-23(30)28-25(32)29(24(20)31)19-9-5-17(26)6-10-19/h2-13H,14H2,1H3,(H,28,30,32)/b20-12+InChIKey
LNKJPGUEALVJPR-UDWIEESQSA-NSynonyms
(5E)1(4BROMOPHENYL)5((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(4((4CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OCC4=CC=C(C=C4)Cl
COc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC25H18BrClN2O5c133221316(41121(22)3414152718(27)8315)122023(30)2825(32)29(24(20)31)199517(26)61019h213H14H21H3(H283032)b2012+
MFCD02781763
STK035517
ZINC000097958483
ZINC97958483
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