N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide Openeye Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide CAS Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide Traditional Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide Formula: C25H19FN2O2S MolecularWeight: 430.493963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=C(C=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN=C(C2=C1C=C(C=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H19FN2O2S/c26-21-8-12-24-20(15-21)13-14-27-25(24)18-5-9-22(10-6-18)28-31(29,30)23-11-7-17-3-1-2-4-19(17)16-23/h1-12,15-16,28H,13-14H2