6-butylsulfanyl-5-methoxy-2-(3-morpholin-4-ylpropyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-butylsulfanyl-5-methoxy-2-(3-morpholin-4-ylpropyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-butylsulfanyl-5-methoxy-2-(3-morpholinopropyl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-(butylthio)-5-methoxy-2-[3-(4-morpholinyl)propyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-butylsulfanyl-5-methoxy-2-(3-morpholin-4-ylpropyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(butylthio)-5-methoxy-2-(3-morpholinopropyl)benzo[de]isoquinoline-1,3-quinone Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=C2C3=C1C=CC=C3C(=O)N(C2=O)CCCN4CCOCC4)OC

Isomeric SMILES

CCCCSC1=C(C=C2C3=C1C=CC=C3C(=O)N(C2=O)CCCN4CCOCC4)OC

InChI

InChI=1S/C24H30N2O4S/c1-3-4-15-31-22-17-7-5-8-18-21(17)19(16-20(22)29-2)24(28)26(23(18)27)10-6-9-25-11-13-30-14-12-25/h5,7-8,16H,3-4,6,9-15H2,1-2H3