Vitas-M small molecule compound
2-oxo-7-phenyl-1,3-benzoxathiol-5-yl (3-methylphenoxy)acetate
Catalog ID
STK881983
SMILES O=C(Oc1cc2sc(=O)oc2c(c1)c1ccccc1)COc1cccc(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 C22H16O5S MW 392.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16O5S/c1-14-6-5-9-16(10-14)25-13-20(23)26-17-11-18(15-7-3-2-4-8-15)21-19(12-17)28-22(24)27-21/h2-12H,13H2,1H3InChIKey
JENHMSSSZJRBDJ-UHFFFAOYSA-NSynonyms
(2oxo7phenyl13benzoxathiol5yl)2(3methylphenoxy)acetate
2oxo7phenyl13benzoxathiol5yl(3methylphenoxy)acetate
CC1=CC(=CC=C1)OCC(=O)OC2=CC3=C(C(=C2)C4=CC=CC=C4)OC(=O)S3
InChI=1SC22H16O5Sc11465916(1014)251320(23)26171118(157324815)2119(1217)2822(24)2721h212H13H21H3
MFCD06645907
ZINC000006809650
ZINC06809650
ZINC6809650
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