3-bromanyl-4-(4-methylsulfanylphenyl)-6-(trifluoromethyl)pyran-2-one

Systemtic Name: 3-bromanyl-4-(4-methylsulfanylphenyl)-6-(trifluoromethyl)pyran-2-one Openeye Name: 3-bromo-4-(4-methylsulfanylphenyl)-6-(trifluoromethyl)pyran-2-one CAS Name: 3-bromo-4-[4-(methylthio)phenyl]-6-(trifluoromethyl)-2-pyranone IUPAC Name: 3-bromo-4-(4-methylsulfanylphenyl)-6-(trifluoromethyl)pyran-2-one Traditional Name: 3-bromo-4-[4-(methylthio)phenyl]-6-(trifluoromethyl)pyran-2-one Formula: C13H8BrF3O2S MolecularWeight: 365.16563

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(=O)OC(=C2)C(F)(F)F)Br

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(=O)OC(=C2)C(F)(F)F)Br

InChI

InChI=1S/C13H8BrF3O2S/c1-20-8-4-2-7(3-5-8)9-6-10(13(15,16)17)19-12(18)11(9)14/h2-6H,1H3