Vitas-M small molecule compound
(5Z)-1-(4-bromophenyl)-5-{4-[(2,6-dichlorobenzyl)oxy]-3-ethoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK098429
SMILES CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)/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 C26H19BrCl2N2O5 MW 590.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19BrCl2N2O5/c1-2-35-23-13-15(6-11-22(23)36-14-19-20(28)4-3-5-21(19)29)12-18-24(32)30-26(34)31(25(18)33)17-9-7-16(27)8-10-17/h3-13H,2,14H2,1H3,(H,30,32,34)/b18-12-InChIKey
QRHJAWFNTJKBAW-PDGQHHTCSA-NSynonyms
(5Z)1(4bromophenyl)5((4((26dichlorophenyl)methoxy)3ethoxyphenyl)methylidene)13diazinane246trione
(5Z)1(4BROMOPHENYL)5(4((26DICHLOROBENZYL)OXY)3ETHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OCC4=C(C=CC=C4Cl)Cl
CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC26H19BrCl2N2O5c1235231315(61122(23)36141920(28)43521(19)29)121824(32)3026(34)31(25(18)33)179716(27)81017h313H214H21H3(H303234)b1812
MFCD05976191
STK098429
ZINC000097959449
ZINC97959449
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