2-(2-phenylsulfanylethyl)-3H-isoindol-1-one

Systemtic Name: 2-(2-phenylsulfanylethyl)-3H-isoindol-1-one Openeye Name: 2-(2-phenylsulfanylethyl)isoindolin-1-one CAS Name: 2-[2-(phenylthio)ethyl]-3H-isoindol-1-one IUPAC Name: 2-(2-phenylsulfanylethyl)-3H-isoindol-1-one Traditional Name: 2-[2-(phenylthio)ethyl]isoindolin-1-one Formula: C16H15NOS MolecularWeight: 269.3614

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1CCSC3=CC=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1CCSC3=CC=CC=C3

InChI

InChI=1S/C16H15NOS/c18-16-15-9-5-4-6-13(15)12-17(16)10-11-19-14-7-2-1-3-8-14/h1-9H,10-12H2