2-methyl-4-[4-methylsulfanyl-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one

Systemtic Name: 2-methyl-4-[4-methylsulfanyl-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one Openeye Name: 2-methyl-4-[4-methylsulfanyl-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one CAS Name: 2-methyl-4-[4-(methylthio)-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one IUPAC Name: 2-methyl-4-[4-methylsulfanyl-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one Traditional Name: 2-methyl-4-[4-(methylthio)-3-(trifluoromethyl)phenyl]-1,2,4-oxadiazinan-3-one Formula: C12H13F3N2O2S MolecularWeight: 306.30403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(CCO1)C2=CC(=C(C=C2)SC)C(F)(F)F

Isomeric SMILES

CN1C(=O)N(CCO1)C2=CC(=C(C=C2)SC)C(F)(F)F

InChI

InChI=1S/C12H13F3N2O2S/c1-16-11(18)17(5-6-19-16)8-3-4-10(20-2)9(7-8)12(13,14)15/h3-4,7H,5-6H2,1-2H3