N-[1-[4-(5-chloranyl-2-methyl-phenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[1-[4-(5-chloranyl-2-methyl-phenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[1-[4-(5-chloro-2-methyl-phenyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[1-[4-(5-chloro-2-methylphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[1-[4-(5-chloro-2-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[1-[4-(5-chloro-2-methyl-phenyl)-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethyl]-3-(trifluoromethyl)benzamide Formula: C27H24ClF3N4OS MolecularWeight: 545.01887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=CC=CC=C3C)C(C)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=CC=CC=C3C)C(C)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C27H24ClF3N4OS/c1-16-7-4-5-8-20(16)15-37-26-34-33-24(35(26)23-14-22(28)12-11-17(23)2)18(3)32-25(36)19-9-6-10-21(13-19)27(29,30)31/h4-14,18H,15H2,1-3H3,(H,32,36)