N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Openeye Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide CAS Name: N-[[5-(ethylthio)-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide IUPAC Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Traditional Name: N-[[5-(ethylthio)-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Formula: C12H15FN4O2S2 MolecularWeight: 330.401503

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)F)CNS(=O)(=O)C

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)F)CNS(=O)(=O)C

InChI

InChI=1S/C12H15FN4O2S2/c1-3-20-12-16-15-11(8-14-21(2,18)19)17(12)10-6-4-9(13)5-7-10/h4-7,14H,3,8H2,1-2H3