6-methyl-3-(2-methylsulfanylethanoyl)-2-oxidanyl-pyran-4-one

Systemtic Name: 6-methyl-3-(2-methylsulfanylethanoyl)-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-6-methyl-3-(2-methylsulfanylacetyl)pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-[2-(methylthio)-1-oxoethyl]-4-pyranone IUPAC Name: 2-hydroxy-6-methyl-3-(2-methylsulfanylacetyl)pyran-4-one Traditional Name: 2-hydroxy-6-methyl-3-[2-(methylthio)acetyl]pyran-4-one Formula: C9H10O4S MolecularWeight: 214.2383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)CSC

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)CSC

InChI

InChI=1S/C9H10O4S/c1-5-3-6(10)8(9(12)13-5)7(11)4-14-2/h3,12H,4H2,1-2H3