N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]-1H-1,2,4-triazol-5-yl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]-1H-1,2,4-triazol-5-yl]-4-fluoro-benzenesulfonamide Formula: C15H12ClFN4O2S2 MolecularWeight: 398.862783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NNC(=N2)NS(=O)(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NNC(=N2)NS(=O)(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C15H12ClFN4O2S2/c16-11-3-1-10(2-4-11)9-24-15-18-14(19-20-15)21-25(22,23)13-7-5-12(17)6-8-13/h1-8H,9H2,(H2,18,19,20,21)