2-[4-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylbutyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylbutyl]isoindole-1,3-dione Openeye Name: 2-[4-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(8-methoxy-4-methyl-2-quinolinyl)thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(8-methoxy-4-methylquinolin-2-yl)sulfanylbutyl]isoindole-1,3-dione Traditional Name: 2-[4-[(8-methoxy-4-methyl-2-quinolyl)thio]butyl]isoindoline-1,3-quinone Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N2O3S/c1-15-14-20(24-21-16(15)10-7-11-19(21)28-2)29-13-6-5-12-25-22(26)17-8-3-4-9-18(17)23(25)27/h3-4,7-11,14H,5-6,12-13H2,1-2H3