Vitas-M small molecule compound
7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl (2,6-dimethylphenoxy)acetate
Catalog ID
STK516164
SMILES O=C(Oc1cc2sc(=O)oc2c(c1)c1ccc(cc1)C)COc1c(C)cccc1C
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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 C24H20O5S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20O5S/c1-14-7-9-17(10-8-14)19-11-18(12-20-23(19)29-24(26)30-20)28-21(25)13-27-22-15(2)5-4-6-16(22)3/h4-12H,13H2,1-3H3InChIKey
FIJIOZAZJACVNZ-UHFFFAOYSA-NSynonyms
(7(4methylphenyl)2oxo13benzoxathiol5yl)2(26dimethylphenoxy)acetate
7(4methylphenyl)2oxo13benzoxathiol5yl(26dimethylphenoxy)acetate
CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)COC4=C(C=CC=C4C)C
InChI=1SC24H20O5Sc1147917(10814)191118(122023(19)2924(26)3020)2821(25)13272215(2)54616(22)3h412H13H213H3
MFCD06645548
ZINC000009408850
ZINC09408850
ZINC9408850
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