(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylsulfanyl)phenyl]methanone

Systemtic Name: (6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylsulfanyl)phenyl]methanone Openeye Name: (6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylsulfanyl)phenyl]methanone CAS Name: (6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylthio)phenyl]methanone IUPAC Name: (6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylsulfanyl)phenyl]methanone Traditional Name: (6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethylthio)phenyl]methanone Formula: C25H22F3NO3S MolecularWeight: 473.50729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)SC(F)(F)F)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)SC(F)(F)F)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H22F3NO3S/c1-31-21-14-18-12-13-29(24(30)17-8-10-19(11-9-17)33-25(26,27)28)23(16-6-4-3-5-7-16)20(18)15-22(21)32-2/h3-11,14-15,23H,12-13H2,1-2H3