10-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-3-(2-dimethylaminoethylsulfanyl)-2-fluoranyl-acridin-9-one

Systemtic Name: 10-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-3-(2-dimethylaminoethylsulfanyl)-2-fluoranyl-acridin-9-one Openeye Name: 3-(2-dimethylaminoethylsulfanyl)-2-fluoro-10-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]acridin-9-one CAS Name: 3-(2-dimethylaminoethylthio)-2-fluoro-10-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-9-acridinone IUPAC Name: 3-(2-dimethylaminoethylsulfanyl)-2-fluoro-10-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]acridin-9-one Traditional Name: 3-(2-dimethylaminoethylthio)-2-fluoro-10-(4-hydroxy-3,5-dimethoxy-benzyl)acridin-9-one Formula: C26H27FN2O4S MolecularWeight: 482.566983

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=C(C=C2C(=C1)N(C3=CC=CC=C3C2=O)CC4=CC(=C(C(=C4)OC)O)OC)F

Isomeric SMILES

CN(C)CCSC1=C(C=C2C(=C1)N(C3=CC=CC=C3C2=O)CC4=CC(=C(C(=C4)OC)O)OC)F

InChI

InChI=1S/C26H27FN2O4S/c1-28(2)9-10-34-24-14-21-18(13-19(24)27)25(30)17-7-5-6-8-20(17)29(21)15-16-11-22(32-3)26(31)23(12-16)33-4/h5-8,11-14,31H,9-10,15H2,1-4H3