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

Systemtic Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethylsulfanyl]phenyl]-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethylsulfanyl]phenyl]-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethylthio]phenyl]-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethylsulfanyl]phenyl]-9-oxo-10H-acridine-4-carboxamide Traditional Name: N-[4-[2-(homoveratrylamino)ethylthio]phenyl]-9-keto-10H-acridine-4-carboxamide Formula: C32H31N3O4S MolecularWeight: 553.67124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCSC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=CC=CC=C5C4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCSC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=CC=CC=C5C4=O)OC

InChI

InChI=1S/C32H31N3O4S/c1-38-28-15-10-21(20-29(28)39-2)16-17-33-18-19-40-23-13-11-22(12-14-23)34-32(37)26-8-5-7-25-30(26)35-27-9-4-3-6-24(27)31(25)36/h3-15,20,33H,16-19H2,1-2H3,(H,34,37)(H,35,36)