2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4,8-dimethyl-2-quinolinyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]ethyl]isoindoline-1,3-quinone Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18N2O2S/c1-13-6-5-9-15-14(2)12-18(22-19(13)15)26-11-10-23-20(24)16-7-3-4-8-17(16)21(23)25/h3-9,12H,10-11H2,1-2H3