N-[(E)-[5-fluoranyl-2-(2-phenylethynyl)phenyl]methylideneamino]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E)-[5-fluoranyl-2-(2-phenylethynyl)phenyl]methylideneamino]-4-methyl-benzenesulfonamide Openeye Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methyleneamino]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methylideneamino]-4-methylbenzenesulfonamide IUPAC Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)phenyl]methylideneamino]-4-methylbenzenesulfonamide Traditional Name: N-[(E)-[5-fluoro-2-(2-phenylethynyl)benzylidene]amino]-4-methyl-benzenesulfonamide Formula: C22H17FN2O2S MolecularWeight: 392.445983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=C(C=CC(=C2)F)C#CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=C(C=CC(=C2)F)C#CC3=CC=CC=C3

InChI

InChI=1S/C22H17FN2O2S/c1-17-7-13-22(14-8-17)28(26,27)25-24-16-20-15-21(23)12-11-19(20)10-9-18-5-3-2-4-6-18/h2-8,11-16,25H,1H3/b24-16+