N-(2-ethylsulfonyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoranyl-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: N-(2-ethylsulfonyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoranyl-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: N-(2-ethylsulfonyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]acetamide CAS Name: N-(2-ethylsulfonyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: N-(2-ethylsulfonyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]acetamide Traditional Name: N-(2-esyl-6-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]acetamide Formula: C21H22F4N2O3S MolecularWeight: 458.469593

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=CC(=C2NC(=O)CC3=CC(=C(C=C3)C(F)(F)F)F)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=CC(=C2NC(=O)CC3=CC(=C(C=C3)C(F)(F)F)F)C

InChI

InChI=1S/C21H22F4N2O3S/c1-3-31(29,30)27-9-8-16-15(12-27)6-4-13(2)20(16)26-19(28)11-14-5-7-17(18(22)10-14)21(23,24)25/h4-7,10H,3,8-9,11-12H2,1-2H3,(H,26,28)