3-[bis(fluoranyl)-phenylsulfanyl-methyl]-2-[(E)-but-2-enyl]-3-oxidanyl-isoindol-1-one

Systemtic Name: 3-[bis(fluoranyl)-phenylsulfanyl-methyl]-2-[(E)-but-2-enyl]-3-oxidanyl-isoindol-1-one Openeye Name: 2-[(E)-but-2-enyl]-3-[difluoro(phenylsulfanyl)methyl]-3-hydroxy-isoindolin-1-one CAS Name: 2-[(E)-but-2-enyl]-3-[difluoro-(phenylthio)methyl]-3-hydroxy-1-isoindolone IUPAC Name: 2-[(E)-but-2-enyl]-3-[difluoro(phenylsulfanyl)methyl]-3-hydroxyisoindol-1-one Traditional Name: 2-[(E)-but-2-enyl]-3-[difluoro-(phenylthio)methyl]-3-hydroxy-isoindolin-1-one Formula: C19H17F2NO2S MolecularWeight: 361.405586

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C(=O)C2=CC=CC=C2C1(C(F)(F)SC3=CC=CC=C3)O

Isomeric SMILES

C/C=C/CN1C(=O)C2=CC=CC=C2C1(C(F)(F)SC3=CC=CC=C3)O

InChI

InChI=1S/C19H17F2NO2S/c1-2-3-13-22-17(23)15-11-7-8-12-16(15)18(22,24)19(20,21)25-14-9-5-4-6-10-14/h2-12,24H,13H2,1H3/b3-2+