2-[(3-phenylsulfanylphenyl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(3-phenylsulfanylphenyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(3-phenylsulfanylphenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[3-(phenylthio)phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(3-phenylsulfanylphenyl)methyl]isoindole-1,3-dione Traditional Name: 2-[3-(phenylthio)benzyl]isoindoline-1,3-quinone Formula: C21H15NO2S MolecularWeight: 345.4143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

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