Vitas-M small molecule compound
(5Z)-1-(3-bromophenyl)-5-{4-[(4-chlorobenzyl)oxy]-3-iodo-5-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175086
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)Br)cc(c1OCc1ccc(cc1)Cl)I
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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 C25H17BrClIN2O5 MW 667.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrClIN2O5/c1-34-21-11-15(10-20(28)22(21)35-13-14-5-7-17(27)8-6-14)9-19-23(31)29-25(33)30(24(19)32)18-4-2-3-16(26)12-18/h2-12H,13H2,1H3,(H,29,31,33)/b19-9-InChIKey
SJSKSBGKTPAZTO-OCKHKDLRSA-NSynonyms
(5Z)1(3bromophenyl)5((4((4chlorophenyl)methoxy)3iodo5methoxyphenyl)methylidene)13diazinane246trione
(5Z)1(3BROMOPHENYL)5(4((4CHLOROBENZYL)OXY)3IODO5METHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Br)I)OCC4=CC=C(C=C4)Cl
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cccc(c2)Br)cc(c1OCc1ccc(cc1)Cl)I
InChI=1SC25H17BrClIN2O5c134211115(1020(28)22(21)3513145717(27)8614)91923(31)2925(33)30(24(19)32)1842316(26)1218h212H13H21H3(H293133)b199
MFCD02782295
ZINC000097960588
ZINC97960588
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