Vitas-M small molecule compound
7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl (2-chlorophenoxy)acetate
Catalog ID
STK516385
SMILES O=C(Oc1cc2sc(=O)oc2c(c1)c1ccc(cc1)C)COc1ccccc1Cl
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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 C22H15ClO5S MW 426.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClO5S/c1-13-6-8-14(9-7-13)16-10-15(11-19-21(16)28-22(25)29-19)27-20(24)12-26-18-5-3-2-4-17(18)23/h2-11H,12H2,1H3InChIKey
RHBVQEPBEIPUDB-UHFFFAOYSA-NSynonyms
(7(4methylphenyl)2oxo13benzoxathiol5yl)2(2chlorophenoxy)acetate
7(4methylphenyl)2oxo13benzoxathiol5yl(2chlorophenoxy)acetate
CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)COC4=CC=CC=C4Cl
InChI=1SC22H15ClO5Sc1136814(9713)161015(111921(16)2822(25)2919)2720(24)122618532417(18)23h211H12H21H3
MFCD06645638
ZINC000009408849
ZINC09408849
ZINC9408849
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