10-[(3,5-dimethoxy-4-prop-2-enoxy-phenyl)methyl]-3-methylsulfanyl-acridin-9-one

Systemtic Name: 10-[(3,5-dimethoxy-4-prop-2-enoxy-phenyl)methyl]-3-methylsulfanyl-acridin-9-one Openeye Name: 10-[(4-allyloxy-3,5-dimethoxy-phenyl)methyl]-3-methylsulfanyl-acridin-9-one CAS Name: 10-[(3,5-dimethoxy-4-prop-2-enoxyphenyl)methyl]-3-(methylthio)-9-acridinone IUPAC Name: 10-[(3,5-dimethoxy-4-prop-2-enoxyphenyl)methyl]-3-methylsulfanylacridin-9-one Traditional Name: 10-(4-allyloxy-3,5-dimethoxy-benzyl)-3-(methylthio)acridin-9-one Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC=C)OC)CN2C3=CC=CC=C3C(=O)C4=C2C=C(C=C4)SC

Isomeric SMILES

COC1=CC(=CC(=C1OCC=C)OC)CN2C3=CC=CC=C3C(=O)C4=C2C=C(C=C4)SC

InChI

InChI=1S/C26H25NO4S/c1-5-12-31-26-23(29-2)13-17(14-24(26)30-3)16-27-21-9-7-6-8-19(21)25(28)20-11-10-18(32-4)15-22(20)27/h5-11,13-15H,1,12,16H2,2-4H3