2-[[4-(phenylmethylsulfanyl)phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-(phenylmethylsulfanyl)phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[(4-benzylsulfanylphenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(phenylmethylthio)phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-benzylsulfanylphenyl)methyl]isoindole-1,3-dione Traditional Name: 2-[4-(benzylthio)benzyl]isoindoline-1,3-quinone Formula: C22H17NO2S MolecularWeight: 359.44088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17NO2S/c24-21-19-8-4-5-9-20(19)22(25)23(21)14-16-10-12-18(13-11-16)26-15-17-6-2-1-3-7-17/h1-13H,14-15H2