2-pyridin-2-ylsulfanylisoindole-1,3-dione

Systemtic Name: 2-pyridin-2-ylsulfanylisoindole-1,3-dione Openeye Name: 2-(2-pyridylsulfanyl)isoindoline-1,3-dione CAS Name: 2-(2-pyridinylthio)isoindole-1,3-dione IUPAC Name: 2-pyridin-2-ylsulfanylisoindole-1,3-dione Traditional Name: 2-(2-pyridylthio)isoindoline-1,3-quinone Formula: C13H8N2O2S MolecularWeight: 256.27982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC=N3

InChI

InChI=1S/C13H8N2O2S/c16-12-9-5-1-2-6-10(9)13(17)15(12)18-11-7-3-4-8-14-11/h1-8H