N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methylsulfanyl-9-oxidanylidene-10H-acridine-4-carboxamide

Systemtic Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methylsulfanyl-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methylsulfanyl-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-(methylthio)-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methylsulfanyl-9-oxo-10H-acridine-4-carboxamide Traditional Name: N-[4-[2-(homoveratrylamino)ethyl]phenyl]-9-keto-5-(methylthio)-10H-acridine-4-carboxamide Formula: C33H33N3O4S MolecularWeight: 567.69782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5SC)OC

InChI

InChI=1S/C33H33N3O4S/c1-39-27-15-12-22(20-28(27)40-2)17-19-34-18-16-21-10-13-23(14-11-21)35-33(38)26-8-4-6-24-30(26)36-31-25(32(24)37)7-5-9-29(31)41-3/h4-15,20,34H,16-19H2,1-3H3,(H,35,38)(H,36,37)