N-[(E)-[5-fluoranyl-2-(2-phenylethynyl)phenyl]methylideneamino]benzenesulfonamide

Systemtic Name: N-[(E)-[5-fluoranyl-2-(2-phenylethynyl)phenyl]methylideneamino]benzenesulfonamide Openeye Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methyleneamino]benzenesulfonamide CAS Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methylideneamino]benzenesulfonamide IUPAC Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methylideneamino]benzenesulfonamide Traditional Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)benzylidene]amino]benzenesulfonamide Formula: C21H15FN2O2S MolecularWeight: 378.419403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C=C(C=C2)F)C=NNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C=C(C=C2)F)/C=N/NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H15FN2O2S/c22-20-14-13-18(12-11-17-7-3-1-4-8-17)19(15-20)16-23-24-27(25,26)21-9-5-2-6-10-21/h1-10,13-16,24H/b23-16+