2-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(7-methoxy-4-phenyl-2-quinolyl)thio]ethyl]isoindoline-1,3-quinone Formula: C26H20N2O3S MolecularWeight: 440.5136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H20N2O3S/c1-31-18-11-12-19-22(17-7-3-2-4-8-17)16-24(27-23(19)15-18)32-14-13-28-25(29)20-9-5-6-10-21(20)26(28)30/h2-12,15-16H,13-14H2,1H3