2-(3-quinolin-2-ylsulfanylpropyl)isoindole-1,3-dione

Systemtic Name: 2-(3-quinolin-2-ylsulfanylpropyl)isoindole-1,3-dione Openeye Name: 2-[3-(2-quinolylsulfanyl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(2-quinolinylthio)propyl]isoindole-1,3-dione IUPAC Name: 2-(3-quinolin-2-ylsulfanylpropyl)isoindole-1,3-dione Traditional Name: 2-[3-(2-quinolylthio)propyl]isoindoline-1,3-quinone Formula: C20H16N2O2S MolecularWeight: 348.41824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H16N2O2S/c23-19-15-7-2-3-8-16(15)20(24)22(19)12-5-13-25-18-11-10-14-6-1-4-9-17(14)21-18/h1-4,6-11H,5,12-13H2