3-fluoranyl-N-[2-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-N-[2-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-3-fluoro-benzenesulfonamide CAS Name: 3-fluoro-N-[2-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-3-fluorobenzenesulfonamide Traditional Name: N-[2-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]-3-fluoro-benzenesulfonamide Formula: C18H19FN4O2S2 MolecularWeight: 406.497463

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C18H19FN4O2S2/c1-23-17(21-22-18(23)26-13-14-6-3-2-4-7-14)10-11-20-27(24,25)16-9-5-8-15(19)12-16/h2-9,12,20H,10-11,13H2,1H3