Vitas-M small molecule compound

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

Catalog ID
STK108406
SMILES Cc1ccc(c(c1)/C=C\1/N=C(OC1=O)c1ccccc1)OCc1cccc(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 C25H21NO3 MW 383.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO3/c1-17-7-6-8-19(13-17)16-28-23-12-11-18(2)14-21(23)15-22-25(27)29-24(26-22)20-9-4-3-5-10-20/h3-15H,16H2,1-2H3/b22-15+
InChIKey
ICRITFWPTDQFNH-PXLXIMEGSA-N
Synonyms

(4E)4((5METHYL2((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)2PHENYL13OXAZOL5ONE
(4E)4(5METHYL2((3METHYLBENZYL)OXY)BENZYLIDENE)2PHENYL13OXAZOL5(4H)ONE
CC1=CC(=CC=C1)COC2=C(C=C(C=C2)C)C=C3C(=O)OC(=N3)C4=CC=CC=C4
Cc1ccc(c(c1)C=C1N=C(OC1=O)c1ccccc1)OCc1cccc(c1)C
InChI=1SC25H21NO3c11776819(1317)162823121118(2)1421(23)152225(27)2924(2622)2094351020h315H16H212H3b2215+
MFCD08672913
ZINC000004680350
ZINC04680350
ZINC4680350

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Available files

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