Vitas-M small molecule compound

(4E)-4-{5-bromo-2-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-phenyl-1,3-oxazol-5(4H)-one

Catalog ID
STK038587
SMILES Brc1ccc(c(c1)/C=C\1/N=C(OC1=O)c1ccccc1)OCCOc1cccc(c1)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 C25H20BrNO4 MW 478.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrNO4/c1-17-6-5-9-21(14-17)29-12-13-30-23-11-10-20(26)15-19(23)16-22-25(28)31-24(27-22)18-7-3-2-4-8-18/h2-11,14-16H,12-13H2,1H3/b22-16+
InChIKey
ASSACPJOZPFBPV-CJLVFECKSA-N
Synonyms

(4E)4((5BROMO2(2(3METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2PHENYL13OXAZOL5ONE
(4E)4(5BROMO2(2(3METHYLPHENOXY)ETHOXY)BENZYLIDENE)2PHENYL13OXAZOL5(4H)ONE
Brc1ccc(c(c1)C=C1N=C(OC1=O)c1ccccc1)OCCOc1cccc(c1)C
CC1=CC(=CC=C1)OCCOC2=C(C=C(C=C2)Br)C=C3C(=O)OC(=N3)C4=CC=CC=C4
InChI=1SC25H20BrNO4c11765921(1417)2912133023111020(26)1519(23)162225(28)3124(2722)187324818h2111416H1213H21H3b2216+
MFCD03227980
STK038587
ZINC000002180137
ZINC02180137
ZINC2180137

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Available files

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