2,5-bis(fluoranyl)-N-[3-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,5-bis(fluoranyl)-N-[3-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Openeye Name: 2,5-difluoro-N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide CAS Name: 2,5-difluoro-N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide IUPAC Name: 2,5-difluoro-N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Traditional Name: 2,5-difluoro-N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Formula: C21H15F3N2O2S MolecularWeight: 416.41621

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=CC(=C2)F)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)F)F

Isomeric SMILES

C1CN=C(C2=C1C=CC(=C2)F)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)F)F

InChI

InChI=1S/C21H15F3N2O2S/c22-15-5-4-13-8-9-25-21(18(13)11-15)14-2-1-3-17(10-14)26-29(27,28)20-12-16(23)6-7-19(20)24/h1-7,10-12,26H,8-9H2