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

Systemtic Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1H-1,2,4-triazole Openeye Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 3-[(2-fluorophenyl)methylthio]-5-(2-methoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-[(2-fluorobenzyl)thio]-5-(2-methoxyphenyl)-1H-1,2,4-triazole Formula: C16H14FN3OS MolecularWeight: 315.365263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3F

InChI

InChI=1S/C16H14FN3OS/c1-21-14-9-5-3-7-12(14)15-18-16(20-19-15)22-10-11-6-2-4-8-13(11)17/h2-9H,10H2,1H3,(H,18,19,20)