3-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-[2-(4-bromophenoxy)ethylthio]-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Formula: C22H17BrFN3OS MolecularWeight: 470.357283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)F)SCCOC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)F)SCCOC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrFN3OS/c23-17-6-12-20(13-7-17)28-14-15-29-22-26-25-21(16-4-2-1-3-5-16)27(22)19-10-8-18(24)9-11-19/h1-13H,14-15H2