4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 4-cyano-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C16H10F3N5O2S MolecularWeight: 393.34311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

InChI

InChI=1S/C16H10F3N5O2S/c17-16(18,19)12-3-6-15(24-10-21-9-22-24)14(7-12)23-27(25,26)13-4-1-11(8-20)2-5-13/h1-7,9-10,23H