6-[(3,4-dimethoxyphenyl)methyl]-2-ethyl-3-(methylamino)-5-methylsulfanyl-9-oxidanylidene-1-phenyl-10H-acridine-4-carboxamide

Systemtic Name: 6-[(3,4-dimethoxyphenyl)methyl]-2-ethyl-3-(methylamino)-5-methylsulfanyl-9-oxidanylidene-1-phenyl-10H-acridine-4-carboxamide Openeye Name: 6-[(3,4-dimethoxyphenyl)methyl]-2-ethyl-3-(methylamino)-5-methylsulfanyl-9-oxo-1-phenyl-10H-acridine-4-carboxamide CAS Name: 6-[(3,4-dimethoxyphenyl)methyl]-2-ethyl-3-(methylamino)-5-(methylthio)-9-oxo-1-phenyl-10H-acridine-4-carboxamide IUPAC Name: 6-[(3,4-dimethoxyphenyl)methyl]-2-ethyl-3-(methylamino)-5-methylsulfanyl-9-oxo-1-phenyl-10H-acridine-4-carboxamide Traditional Name: 2-ethyl-9-keto-3-(methylamino)-5-(methylthio)-1-phenyl-6-veratryl-10H-acridine-4-carboxamide Formula: C33H33N3O4S MolecularWeight: 567.69782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1C3=CC=CC=C3)C(=O)C4=C(N2)C(=C(C=C4)CC5=CC(=C(C=C5)OC)OC)SC)C(=O)N)NC

Isomeric SMILES

CCC1=C(C(=C2C(=C1C3=CC=CC=C3)C(=O)C4=C(N2)C(=C(C=C4)CC5=CC(=C(C=C5)OC)OC)SC)C(=O)N)NC

InChI

InChI=1S/C33H33N3O4S/c1-6-21-25(19-10-8-7-9-11-19)26-30(27(33(34)38)28(21)35-2)36-29-22(31(26)37)14-13-20(32(29)41-5)16-18-12-15-23(39-3)24(17-18)40-4/h7-15,17,35H,6,16H2,1-5H3,(H2,34,38)(H,36,37)