5-(1,3-benzodioxol-5-yl)-2-methylsulfanyl-pyran-4-one

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-2-methylsulfanyl-pyran-4-one Openeye Name: 5-(1,3-benzodioxol-5-yl)-2-methylsulfanyl-pyran-4-one CAS Name: 5-(1,3-benzodioxol-5-yl)-2-(methylthio)-4-pyranone IUPAC Name: 5-(1,3-benzodioxol-5-yl)-2-methylsulfanylpyran-4-one Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-(methylthio)pyran-4-one Formula: C13H10O4S MolecularWeight: 262.2811

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=O)C(=CO1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSC1=CC(=O)C(=CO1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H10O4S/c1-18-13-5-10(14)9(6-15-13)8-2-3-11-12(4-8)17-7-16-11/h2-6H,7H2,1H3