Vitas-M small molecule compound
methyl 3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}-3-(quinoxalin-5-yl)propanoate
Catalog ID
STL319866
SMILES COC(=O)CC(c1cccc2c1nccn2)c1oc(CSc2ccccc2)cc(=O)c1O
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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 C24H20N2O5S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O5S/c1-30-21(28)13-18(17-8-5-9-19-22(17)26-11-10-25-19)24-23(29)20(27)12-15(31-24)14-32-16-6-3-2-4-7-16/h2-12,18,29H,13-14H2,1H3InChIKey
YESKGHPYBWLSRD-UHFFFAOYSA-NSynonyms
1435992-71-41435992714
COC(=O)CC(C1=C2C(=CC=C1)N=CC=N2)C3=C(C(=O)C=C(O3)CSC4=CC=CC=C4)O
InChI=1SC24H20N2O5Sc13021(28)1318(178591922(17)2611102519)2423(29)20(27)1215(3124)1432166324716h2121829H1314H21H3
methyl3(3hydroxy4oxo6((phenylsulfanyl)methyl)4Hpyran2yl)3(quinoxalin5yl)propanoate
methyl3(3hydroxy4oxo6((phenylthio)methyl)4Hpyran2yl)3(quinoxalin5yl)propanoate
methyl3(3hydroxy4oxo6(phenylsulfanylmethyl)pyran2yl)3quinoxalin5ylpropanoate
MFCD23138239
ZINC000095480395
ZINC000095480396
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