Vitas-M small molecule compound

methyl 3-(6-{[(2-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-phenylpropanoate

Catalog ID
STL318119
SMILES COC(=O)CC(c1oc(CSc2ccccc2F)cc(=O)c1O)c1ccccc1

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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 C22H19FO5S MW 414.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FO5S/c1-27-20(25)12-16(14-7-3-2-4-8-14)22-21(26)18(24)11-15(28-22)13-29-19-10-6-5-9-17(19)23/h2-11,16,26H,12-13H2,1H3
InChIKey
KDFWVHKFLUNJIS-UHFFFAOYSA-N
Synonyms
1435998-78-9
1435998789
COC(=O)CC(C1=CC=CC=C1)C2=C(C(=O)C=C(O2)CSC3=CC=CC=C3F)O
InChI=1SC22H19FO5Sc12720(25)1216(147324814)2221(26)18(24)1115(2822)1329191065917(19)23h2111626H1213H21H3
methyl3(6(((2fluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)3phenylpropanoate
methyl3(6(((2fluorophenyl)thio)methyl)3hydroxy4oxo4Hpyran2yl)3phenylpropanoate
methyl3(6((2fluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)3phenylpropanoate
MFCD23139146
ZINC000095479054
ZINC000095479055

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Available files

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