5-(3-methoxyphenyl)-2-methylsulfanyl-pyran-4-one

Systemtic Name: 5-(3-methoxyphenyl)-2-methylsulfanyl-pyran-4-one Openeye Name: 5-(3-methoxyphenyl)-2-methylsulfanyl-pyran-4-one CAS Name: 5-(3-methoxyphenyl)-2-(methylthio)-4-pyranone IUPAC Name: 5-(3-methoxyphenyl)-2-methylsulfanylpyran-4-one Traditional Name: 5-(3-methoxyphenyl)-2-(methylthio)pyran-4-one Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=COC(=CC2=O)SC

Isomeric SMILES

COC1=CC=CC(=C1)C2=COC(=CC2=O)SC

InChI

InChI=1S/C13H12O3S/c1-15-10-5-3-4-9(6-10)11-8-16-13(17-2)7-12(11)14/h3-8H,1-2H3