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

Systemtic Name: 2-[2-(phenylmethylsulfanyl)phenyl]isoindole-1,3-dione Openeye Name: 2-(2-benzylsulfanylphenyl)isoindoline-1,3-dione CAS Name: 2-[2-(phenylmethylthio)phenyl]isoindole-1,3-dione IUPAC Name: 2-(2-benzylsulfanylphenyl)isoindole-1,3-dione Traditional Name: 2-[2-(benzylthio)phenyl]isoindoline-1,3-quinone Formula: C21H15NO2S MolecularWeight: 345.4143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H15NO2S/c23-20-16-10-4-5-11-17(16)21(24)22(20)18-12-6-7-13-19(18)25-14-15-8-2-1-3-9-15/h1-13H,14H2