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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

InChI

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