3-oxidanyl-2-[(phenylmethylsulfanyl)methyl]-3H-isoindol-1-one

Systemtic Name: 3-oxidanyl-2-[(phenylmethylsulfanyl)methyl]-3H-isoindol-1-one Openeye Name: 2-(benzylsulfanylmethyl)-3-hydroxy-isoindolin-1-one CAS Name: 3-hydroxy-2-[(phenylmethylthio)methyl]-3H-isoindol-1-one IUPAC Name: 2-(benzylsulfanylmethyl)-3-hydroxy-3H-isoindol-1-one Traditional Name: 2-[(benzylthio)methyl]-3-hydroxy-isoindolin-1-one Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCN2C(C3=CC=CC=C3C2=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSCN2C(C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C16H15NO2S/c18-15-13-8-4-5-9-14(13)16(19)17(15)11-20-10-12-6-2-1-3-7-12/h1-9,15,18H,10-11H2