Vitas-M small molecule compound

methyl 3-(6-{[(2-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-5-methylhexanoate

Catalog ID
STL313824
SMILES COC(=O)CC(c1oc(CSc2ccccc2F)cc(=O)c1O)CC(C)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 C20H23FO5S MW 394.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FO5S/c1-12(2)8-13(9-18(23)25-3)20-19(24)16(22)10-14(26-20)11-27-17-7-5-4-6-15(17)21/h4-7,10,12-13,24H,8-9,11H2,1-3H3
InChIKey
SROIINAMUBFVLN-UHFFFAOYSA-N
Synonyms
1435993-22-8
1435993228
CC(C)CC(CC(=O)OC)C1=C(C(=O)C=C(O1)CSC2=CC=CC=C2F)O
InChI=1SC20H23FO5Sc112(2)813(918(23)253)2019(24)16(22)1014(2620)112717754615(17)21h4710121324H8911H213H3
methyl3(6(((2fluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)5methylhexanoate
methyl3(6(((2fluorophenyl)thio)methyl)3hydroxy4oxo4Hpyran2yl)5methylhexanoate
methyl3(6((2fluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)5methylhexanoate
MFCD23138318
ZINC000095475888
ZINC000095475889

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Available files

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