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

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole Openeye Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole CAS Name: 3-[(4-fluorophenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole Traditional Name: 3-[(4-fluorobenzyl)thio]-5-p-anisyl-1H-1,2,4-triazole Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H16FN3OS/c1-22-15-8-4-12(5-9-15)10-16-19-17(21-20-16)23-11-13-2-6-14(18)7-3-13/h2-9H,10-11H2,1H3,(H,19,20,21)