N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-5-methyl-9-oxidanylidene-10H-acridine-4-carboxamide

Systemtic Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-5-methyl-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-5-methyl-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]phenyl]-5-methyl-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]phenyl]-5-methyl-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-5-methyl-10H-acridine-4-carboxamide Formula: C35H35N3O4S MolecularWeight: 593.7351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC3=C(C2=O)C=CC=C3C(=O)NC4=CC=C(C=C4)SCCCN5CCC6=CC(=C(C=C6C5)OC)OC

Isomeric SMILES

CC1=CC=CC2=C1NC3=C(C2=O)C=CC=C3C(=O)NC4=CC=C(C=C4)SCCCN5CCC6=CC(=C(C=C6C5)OC)OC

InChI

InChI=1S/C35H35N3O4S/c1-22-7-4-8-27-32(22)37-33-28(34(27)39)9-5-10-29(33)35(40)36-25-11-13-26(14-12-25)43-18-6-16-38-17-15-23-19-30(41-2)31(42-3)20-24(23)21-38/h4-5,7-14,19-20H,6,15-18,21H2,1-3H3,(H,36,40)(H,37,39)