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

Systemtic Name: 3-[bis(fluoranyl)-phenylsulfanyl-methyl]-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-[difluoro(phenylsulfanyl)methyl]-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-[difluoro-(phenylthio)methyl]-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-[difluoro(phenylsulfanyl)methyl]-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-[difluoro-(phenylthio)methyl]-3-hydroxy-2-methyl-isoindolin-1-one Formula: C16H13F2NO2S MolecularWeight: 321.341726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F2NO2S/c1-19-14(20)12-9-5-6-10-13(12)15(19,21)16(17,18)22-11-7-3-2-4-8-11/h2-10,21H,1H3