Vitas-M small molecule compound

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

Catalog ID
STK957538
SMILES CCOc1cc(/C=C\2/N=C(OC2=O)c2ccc(cc2)F)cc(c1OCc1cccc(c1)C)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 C26H21BrFNO4 MW 510.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrFNO4/c1-3-31-23-14-18(12-21(27)24(23)32-15-17-6-4-5-16(2)11-17)13-22-26(30)33-25(29-22)19-7-9-20(28)10-8-19/h4-14H,3,15H2,1-2H3/b22-13+
InChIKey
UQWUJEOULZCWNX-LPYMAVHISA-N
Synonyms
353475-18-0
(4E)4((3BROMO5ETHOXY4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)2(4FLUOROPHENYL)13OXAZOL5ONE
(4E)4(3bromo5ethoxy4((3methylbenzyl)oxy)benzylidene)2(4fluorophenyl)13oxazol5(4H)one
353475180
4(3BROMO5ETHOXY4((3METHYLBENZYL)OXY)BENZYLIDENE)2(4FLUOROPHENYL)13OXAZOL5(4H)ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)F)Br)OCC4=CC=CC(=C4)C
CCOc1cc(C=C2N=C(OC2=O)c2ccc(cc2)F)cc(c1OCc1cccc(c1)C)Br
InChI=1SC26H21BrFNO4c1331231418(1221(27)24(23)32151764516(2)1117)132226(30)3325(2922)197920(28)10819h414H315H212H3b2213+
MFCD01647745
ZINC000002083989
ZINC02083989
ZINC2083989

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Available files

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