2-(cyanomethyl)-5-(4-fluorophenyl)-3-(1,3-thiazol-4-yl)benzenesulfonamide

Systemtic Name: 2-(cyanomethyl)-5-(4-fluorophenyl)-3-(1,3-thiazol-4-yl)benzenesulfonamide Openeye Name: 2-(cyanomethyl)-5-(4-fluorophenyl)-3-thiazol-4-yl-benzenesulfonamide CAS Name: 2-(cyanomethyl)-5-(4-fluorophenyl)-3-(4-thiazolyl)benzenesulfonamide IUPAC Name: 2-(cyanomethyl)-5-(4-fluorophenyl)-3-(1,3-thiazol-4-yl)benzenesulfonamide Traditional Name: 2-(cyanomethyl)-5-(4-fluorophenyl)-3-thiazol-4-yl-benzenesulfonamide Formula: C17H12FN3O2S2 MolecularWeight: 373.424483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C(=C2)S(=O)(=O)N)CC#N)C3=CSC=N3)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C(=C2)S(=O)(=O)N)CC#N)C3=CSC=N3)F

InChI

InChI=1S/C17H12FN3O2S2/c18-13-3-1-11(2-4-13)12-7-15(16-9-24-10-21-16)14(5-6-19)17(8-12)25(20,22)23/h1-4,7-10H,5H2,(H2,20,22,23)