(5-methylsulfonyl-2-morpholin-4-yl-phenyl)-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: (5-methylsulfonyl-2-morpholin-4-yl-phenyl)-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: (5-methylsulfonyl-2-morpholino-phenyl)-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: [5-methylsulfonyl-2-(4-morpholinyl)phenyl]-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: (5-methylsulfonyl-2-morpholin-4-ylphenyl)-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: (5-mesyl-2-morpholino-phenyl)-[6-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C22H23F3N2O4S MolecularWeight: 468.48923

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCC4=C(C3)C=CC(=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCC4=C(C3)C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O4S/c1-32(29,30)18-4-5-20(26-8-10-31-11-9-26)19(13-18)21(28)27-7-6-15-12-17(22(23,24)25)3-2-16(15)14-27/h2-5,12-13H,6-11,14H2,1H3