3-[(2-fluoranylphenoxy)methyl]-4-phenyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-[(2-fluoranylphenoxy)methyl]-4-phenyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[(2-fluorophenoxy)methyl]-4-phenyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-fluorophenoxy)methyl]-4-phenyl-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3-[(2-fluorophenoxy)methyl]-4-phenyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[(2-fluorophenoxy)methyl]-4-phenyl-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazole Formula: C25H20FN5OS MolecularWeight: 457.522603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)COC5=CC=CC=C5F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)COC5=CC=CC=C5F

InChI

InChI=1S/C25H20FN5OS/c26-22-9-4-5-10-23(22)32-17-24-28-29-25(31(24)21-7-2-1-3-8-21)33-18-19-11-13-20(14-12-19)30-16-6-15-27-30/h1-16H,17-18H2