3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylmethoxyphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylmethoxyphenyl)-1H-1,2,4-triazole Openeye Name: 5-(2-benzyloxyphenyl)-3-[(2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 3-[(2-fluorophenyl)methylthio]-5-(2-phenylmethoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylmethoxyphenyl)-1H-1,2,4-triazole Traditional Name: 5-(2-benzoxyphenyl)-3-[(2-fluorobenzyl)thio]-1H-1,2,4-triazole Formula: C22H18FN3OS MolecularWeight: 391.461223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC(=NN3)SCC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC(=NN3)SCC4=CC=CC=C4F

InChI

InChI=1S/C22H18FN3OS/c23-19-12-6-4-10-17(19)15-28-22-24-21(25-26-22)18-11-5-7-13-20(18)27-14-16-8-2-1-3-9-16/h1-13H,14-15H2,(H,24,25,26)