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

Systemtic Name: 5-fluoranyl-2-methyl-N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]benzenesulfonamide Openeye Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)-5-fluoro-2-methyl-benzenesulfonamide CAS Name: 5-fluoro-2-methyl-N-[3-(phenylmethylthio)-1H-1,2,4-triazol-5-yl]benzenesulfonamide IUPAC Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)-5-fluoro-2-methylbenzenesulfonamide Traditional Name: N-[3-(benzylthio)-1H-1,2,4-triazol-5-yl]-5-fluoro-2-methyl-benzenesulfonamide Formula: C16H15FN4O2S2 MolecularWeight: 378.444303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=NC(=NN2)SCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=NC(=NN2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H15FN4O2S2/c1-11-7-8-13(17)9-14(11)25(22,23)21-15-18-16(20-19-15)24-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2,18,19,20,21)