Vitas-M small molecule compound
2-oxo-7-phenyl-1,3-benzoxathiol-5-yl (4-bromophenoxy)acetate
Catalog ID
STK911281
SMILES O=C(Oc1cc2sc(=O)oc2c(c1)c1ccccc1)COc1ccc(cc1)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 C21H13BrO5S MW 457.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrO5S/c22-14-6-8-15(9-7-14)25-12-19(23)26-16-10-17(13-4-2-1-3-5-13)20-18(11-16)28-21(24)27-20/h1-11H,12H2InChIKey
ABLPVCXSNFPIBJ-UHFFFAOYSA-NSynonyms
(2oxo7phenyl13benzoxathiol5yl)2(4bromophenoxy)acetate
2oxo7phenyl13benzoxathiol5yl(4bromophenoxy)acetate
C1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)COC4=CC=C(C=C4)Br
InChI=1SC21H13BrO5Sc22146815(9714)251219(23)26161017(134213513)2018(1116)2821(24)2720h111H12H2
MFCD07426191
ZINC000008915400
ZINC08915400
ZINC8915400
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