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

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-fluoro-benzenesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutyl]-3-fluorobenzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-fluoro-benzenesulfonamide Formula: C20H25FN2O2S MolecularWeight: 376.488103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNS(=O)(=O)C1=CC=CC(=C1)F)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)C(CNS(=O)(=O)C1=CC=CC(=C1)F)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H25FN2O2S/c1-15(2)20(23-11-10-16-6-3-4-7-17(16)14-23)13-22-26(24,25)19-9-5-8-18(21)12-19/h3-9,12,15,20,22H,10-11,13-14H2,1-2H3