N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(3-fluorophenyl)-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(3-fluorophenyl)-4-(methylthio)benzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(3-fluorophenyl)-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-(3-fluorophenyl)-4-(methylthio)benzenesulfonamide Formula: C24H23FN2O3S2 MolecularWeight: 470.579423

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H23FN2O3S2/c1-31-22-9-11-23(12-10-22)32(29,30)27(21-8-4-7-20(25)15-21)17-24(28)26-14-13-18-5-2-3-6-19(18)16-26/h2-12,15H,13-14,16-17H2,1H3