5-oxidanyl-2-(propan-2-ylsulfanylmethyl)pyran-4-one

Systemtic Name: 5-oxidanyl-2-(propan-2-ylsulfanylmethyl)pyran-4-one Openeye Name: 5-hydroxy-2-(isopropylsulfanylmethyl)pyran-4-one CAS Name: 5-hydroxy-2-[(propan-2-ylthio)methyl]-4-pyranone IUPAC Name: 5-hydroxy-2-(propan-2-ylsulfanylmethyl)pyran-4-one Traditional Name: 5-hydroxy-2-[(isopropylthio)methyl]pyran-4-one Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=CC(=O)C(=CO1)O

Isomeric SMILES

CC(C)SCC1=CC(=O)C(=CO1)O

InChI

InChI=1S/C9H12O3S/c1-6(2)13-5-7-3-8(10)9(11)4-12-7/h3-4,6,11H,5H2,1-2H3