2-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[3-(trifluoromethyl)phenyl]methylthio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[3-(trifluoromethyl)benzyl]thio]ethyl]isoindoline-1,3-quinone Formula: C18H14F3NO2S MolecularWeight: 365.36947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3NO2S/c19-18(20,21)13-5-3-4-12(10-13)11-25-9-8-22-16(23)14-6-1-2-7-15(14)17(22)24/h1-7,10H,8-9,11H2