N-[4-bromanyl-2-(trifluoromethyl)phenyl]-2-[[4-(4-fluorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-bromanyl-2-(trifluoromethyl)phenyl]-2-[[4-(4-fluorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-benzyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide CAS Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-2-[[4-(4-fluorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-benzyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[5-benzyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide Formula: C24H17BrF4N4OS MolecularWeight: 565.380593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=C(C=C(C=C4)Br)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=C(C=C(C=C4)Br)C(F)(F)F

InChI

InChI=1S/C24H17BrF4N4OS/c25-16-6-11-20(19(13-16)24(27,28)29)30-22(34)14-35-23-32-31-21(12-15-4-2-1-3-5-15)33(23)18-9-7-17(26)8-10-18/h1-11,13H,12,14H2,(H,30,34)