Vitas-M small molecule compound

4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-thiochromen-2-one

Catalog ID
STK365429
SMILES CC(=O)CC(c1c(=O)sc2c(c1O)cccc2)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 C19H16O3S MW 324.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16O3S/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
InChIKey
KRMBKNSOMHWYFC-UHFFFAOYSA-N
Synonyms
19851-12-8
19851128
4hydroxy3(3oxo1phenylbutyl)2Hthiochromen2one
MFCD00396888
ZINC000003149495
ZINC000003149496

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.