3-[1-ethylsulfanyl-2,2,2-tris(fluoranyl)ethyl]-5-methyl-5-oxidanyl-1-propan-2-yl-pyrrol-2-one

Systemtic Name: 3-[1-ethylsulfanyl-2,2,2-tris(fluoranyl)ethyl]-5-methyl-5-oxidanyl-1-propan-2-yl-pyrrol-2-one Openeye Name: 3-(1-ethylsulfanyl-2,2,2-trifluoro-ethyl)-5-hydroxy-1-isopropyl-5-methyl-pyrrol-2-one CAS Name: 3-[1-(ethylthio)-2,2,2-trifluoroethyl]-5-hydroxy-5-methyl-1-propan-2-yl-2-pyrrolone IUPAC Name: 3-(1-ethylsulfanyl-2,2,2-trifluoroethyl)-5-hydroxy-5-methyl-1-propan-2-ylpyrrol-2-one Traditional Name: 3-[1-(ethylthio)-2,2,2-trifluoro-ethyl]-5-hydroxy-1-isopropyl-5-methyl-3-pyrrolin-2-one Formula: C12H18F3NO2S MolecularWeight: 297.33703

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1=CC(N(C1=O)C(C)C)(C)O)C(F)(F)F

Isomeric SMILES

CCSC(C1=CC(N(C1=O)C(C)C)(C)O)C(F)(F)F

InChI

InChI=1S/C12H18F3NO2S/c1-5-19-9(12(13,14)15)8-6-11(4,18)16(7(2)3)10(8)17/h6-7,9,18H,5H2,1-4H3