N-[[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Openeye Name: N-[[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide CAS Name: N-[[5-[(2-chloro-6-fluorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide IUPAC Name: N-[[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Traditional Name: N-[[5-[(2-chloro-6-fluoro-benzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Formula: C18H18ClFN4O2S2 MolecularWeight: 440.942523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)CNS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)CNS(=O)(=O)C

InChI

InChI=1S/C18H18ClFN4O2S2/c1-12-6-8-13(9-7-12)24-17(10-21-28(2,25)26)22-23-18(24)27-11-14-15(19)4-3-5-16(14)20/h3-9,21H,10-11H2,1-2H3