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

Systemtic Name: 2-[2-(2-methylquinolin-4-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(2-methyl-4-quinolyl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(2-methyl-4-quinolinyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(2-methylquinolin-4-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(2-methyl-4-quinolyl)thio]ethyl]isoindoline-1,3-quinone Formula: C20H16N2O2S MolecularWeight: 348.41824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H16N2O2S/c1-13-12-18(16-8-4-5-9-17(16)21-13)25-11-10-22-19(23)14-6-2-3-7-15(14)20(22)24/h2-9,12H,10-11H2,1H3