Vitas-M small molecule compound

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

Catalog ID
STL319127
SMILES COC(=O)CC(c1oc(CSc2ccccc2)cc(=O)c1O)c1ccc(cc1)F

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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)12-18(14-7-9-15(23)10-8-14)22-21(26)19(24)11-16(28-22)13-29-17-5-3-2-4-6-17/h2-11,18,26H,12-13H2,1H3
InChIKey
QINIXBUHSMQZCO-UHFFFAOYSA-N
Synonyms
1436004-25-9
1436004259
COC(=O)CC(C1=CC=C(C=C1)F)C2=C(C(=O)C=C(O2)CSC3=CC=CC=C3)O
InChI=1SC22H19FO5Sc12720(25)1218(147915(23)10814)2221(26)19(24)1116(2822)1329175324617h2111826H1213H21H3
methyl3(4fluorophenyl)3(3hydroxy4oxo6((phenylsulfanyl)methyl)4Hpyran2yl)propanoate
methyl3(4fluorophenyl)3(3hydroxy4oxo6((phenylthio)methyl)4Hpyran2yl)propanoate
methyl3(4fluorophenyl)3(3hydroxy4oxo6(phenylsulfanylmethyl)pyran2yl)propanoate
MFCD23137412
ZINC000095479831
ZINC000095479832

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Available files

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