5-[(4-methylsulfanylphenyl)methylamino]isoindole-1,3-dione

Systemtic Name: 5-[(4-methylsulfanylphenyl)methylamino]isoindole-1,3-dione Openeye Name: 5-[(4-methylsulfanylphenyl)methylamino]isoindoline-1,3-dione CAS Name: 5-[[4-(methylthio)phenyl]methylamino]isoindole-1,3-dione IUPAC Name: 5-[(4-methylsulfanylphenyl)methylamino]isoindole-1,3-dione Traditional Name: 5-[[4-(methylthio)benzyl]amino]isoindoline-1,3-quinone Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

CSC1=CC=C(C=C1)CNC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C16H14N2O2S/c1-21-12-5-2-10(3-6-12)9-17-11-4-7-13-14(8-11)16(20)18-15(13)19/h2-8,17H,9H2,1H3,(H,18,19,20)