Vitas-M small molecule compound
(4E)-4-{4-[(3,4-dichlorobenzyl)oxy]-3-methoxybenzylidene}-2-(4-methylphenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK771643
SMILES COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C\1/N=C(OC1=O)c1ccc(cc1)C
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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 C25H19Cl2NO4 MW 468.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2NO4/c1-15-3-7-18(8-4-15)24-28-21(25(29)32-24)12-16-6-10-22(23(13-16)30-2)31-14-17-5-9-19(26)20(27)11-17/h3-13H,14H2,1-2H3/b21-12+InChIKey
QQWVAOHKJZVZAO-CIAFOILYSA-NSynonyms
(4E)4((4((34DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)2(4METHYLPHENYL)13OXAZOL5ONE
(4E)4(4((34dichlorobenzyl)oxy)3methoxybenzylidene)2(4methylphenyl)13oxazol5(4H)one
CC1=CC=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)OCC4=CC(=C(C=C4)Cl)Cl)OC)C(=O)O2
COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C1N=C(OC1=O)c1ccc(cc1)C
InChI=1SC25H19Cl2NO4c1153718(8415)242821(25(29)3224)121661022(23(1316)302)3114175919(26)20(27)1117h313H14H212H3b2112+
MFCD02581373
ZINC000002929617
ZINC02929617
ZINC2929617
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