Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-{3-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK009125
SMILES COc1cc(ccc1OCc1ccccc1C)/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 C26H21BrN2O5 MW 521.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrN2O5/c1-16-5-3-4-6-18(16)15-34-22-12-7-17(14-23(22)33-2)13-21-24(30)28-26(32)29(25(21)31)20-10-8-19(27)9-11-20/h3-14H,15H2,1-2H3,(H,28,30,32)/b21-13+InChIKey
ZRCWGACZGFCHOH-FYJGNVAPSA-NSynonyms
(5E)1(4BROMOPHENYL)5((3METHOXY4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(3METHOXY4((2METHYLBENZYL)OXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC=CC=C1COC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br)OC
COc1cc(ccc1OCc1ccccc1C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC26H21BrN2O5c116534618(16)15342212717(1423(22)332)132124(30)2826(32)29(25(21)31)2010819(27)91120h314H15H212H3(H283032)b2113+
MFCD08049323
STK009125
ZINC000097957839
ZINC97957839
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