N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Formula: C23H21FN2O4S MolecularWeight: 440.487243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=C(C=C2)C3=NCCC4=C3C=CC(=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=C(C=C2)C3=NCCC4=C3C=CC(=C4)F

InChI

InChI=1S/C23H21FN2O4S/c1-29-19-8-10-21(30-2)22(14-19)31(27,28)26-18-6-3-15(4-7-18)23-20-9-5-17(24)13-16(20)11-12-25-23/h3-10,13-14,26H,11-12H2,1-2H3