2-[2-(phenylmethylsulfanyl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(phenylmethylsulfanyl)ethyl]isoindole-1,3-dione Openeye Name: 2-(2-benzylsulfanylethyl)isoindoline-1,3-dione CAS Name: 2-[2-(phenylmethylthio)ethyl]isoindole-1,3-dione IUPAC Name: 2-(2-benzylsulfanylethyl)isoindole-1,3-dione Traditional Name: 2-[2-(benzylthio)ethyl]isoindoline-1,3-quinone Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)CSCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H15NO2S/c19-16-14-8-4-5-9-15(14)17(20)18(16)10-11-21-12-13-6-2-1-3-7-13/h1-9H,10-12H2