2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-[3-(trifluoromethyl)phenyl]ethanone Formula: C23H15F4N3OS MolecularWeight: 457.443313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H15F4N3OS/c24-18-9-11-19(12-10-18)30-21(15-5-2-1-3-6-15)28-29-22(30)32-14-20(31)16-7-4-8-17(13-16)23(25,26)27/h1-13H,14H2