N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-9-oxidanylidene-10H-acridine-4-carboxamide

Systemtic Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]phenyl]-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-9-oxo-10H-acridine-4-carboxamide Traditional Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]phenyl]-9-keto-10H-acridine-4-carboxamide Formula: C34H33N3O4S MolecularWeight: 579.70852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCSC3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4NC6=CC=CC=C6C5=O)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCSC3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4NC6=CC=CC=C6C5=O)OC

InChI

InChI=1S/C34H33N3O4S/c1-40-30-19-22-15-17-37(21-23(22)20-31(30)41-2)16-6-18-42-25-13-11-24(12-14-25)35-34(39)28-9-5-8-27-32(28)36-29-10-4-3-7-26(29)33(27)38/h3-5,7-14,19-20H,6,15-18,21H2,1-2H3,(H,35,39)(H,36,38)