Vitas-M small molecule compound
(4E)-4-{3-bromo-5-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Catalog ID
STK957519
SMILES COc1cc(/C=C\2/N=C(OC2=O)c2cccs2)cc(c1OCc1ccccc1C)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 C23H18BrNO4S MW 484.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrNO4S/c1-14-6-3-4-7-16(14)13-28-21-17(24)10-15(12-19(21)27-2)11-18-23(26)29-22(25-18)20-8-5-9-30-20/h3-12H,13H2,1-2H3/b18-11+InChIKey
SAETZZBMTVDSMK-WOJGMQOQSA-NSynonyms
(4E)4((3bromo5methoxy4((2methylphenyl)methoxy)phenyl)methylidene)2thiophen2yl13oxazol5one
(4E)4(3bromo5methoxy4((2methylbenzyl)oxy)benzylidene)2(thiophen2yl)13oxazol5(4H)one
CC1=CC=CC=C1COC2=C(C=C(C=C2Br)C=C3C(=O)OC(=N3)C4=CC=CS4)OC
COc1cc(C=C2N=C(OC2=O)c2cccs2)cc(c1OCc1ccccc1C)Br
InChI=1SC23H18BrNO4Sc114634716(14)13282117(24)1015(1219(21)272)111823(26)2922(2518)208593020h312H13H212H3b1811+
MFCD01450124
ZINC000002741381
ZINC02741381
ZINC2741381
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