N-[4-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide Openeye Name: N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide CAS Name: N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-2-sulfonamide Traditional Name: N-[4-(7-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=CC(=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

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

InChI

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