Vitas-M small molecule compound
methyl 3-(6-{[(2,4-difluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(pyridin-3-yl)propanoate
Catalog ID
STL320566
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2F)F)cc(=O)c1O)c1cccnc1
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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 C21H17F2NO5S MW 433.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F2NO5S/c1-28-19(26)9-15(12-3-2-6-24-10-12)21-20(27)17(25)8-14(29-21)11-30-18-5-4-13(22)7-16(18)23/h2-8,10,15,27H,9,11H2,1H3InChIKey
ARVSLQMWOYHKDU-UHFFFAOYSA-NSynonyms
1442075-92-41442075924
COC(=O)CC(C1=CN=CC=C1)C2=C(C(=O)C=C(O2)CSC3=C(C=C(C=C3)F)F)O
InChI=1SC21H17F2NO5Sc12819(26)915(12326241012)2120(27)17(25)814(2921)1130185413(22)716(18)23h28101527H911H21H3
methyl3(6(((24difluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)3(pyridin3yl)propanoate
methyl3(6(((24difluorophenyl)thio)methyl)3hydroxy4oxo4Hpyran2yl)3(pyridin3yl)propanoate
methyl3(6((24difluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)3pyridin3ylpropanoate
MFCD28029567
ZINC000095480900
ZINC000095480901
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