N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-butyl-N-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C23H27F3N2O3S MolecularWeight: 468.53229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C23H27F3N2O3S/c1-3-4-13-27(32(30,31)20-10-7-9-19(15-20)23(24,25)26)16-22(29)28-14-12-18-8-5-6-11-21(18)17(28)2/h5-11,15,17H,3-4,12-14,16H2,1-2H3