3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(2-fluorophenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(2-fluorophenyl)-1H-1,2,4-triazole Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-5-(2-fluorophenyl)-1H-1,2,4-triazole CAS Name: 3-[(4-bromo-2-fluorophenyl)methylthio]-5-(2-fluorophenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylsulfanyl]-5-(2-fluorophenyl)-1H-1,2,4-triazole Traditional Name: 3-[(4-bromo-2-fluoro-benzyl)thio]-5-(2-fluorophenyl)-1H-1,2,4-triazole Formula: C15H10BrF2N3S MolecularWeight: 382.225806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=C(C=C(C=C3)Br)F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=C(C=C(C=C3)Br)F)F

InChI

InChI=1S/C15H10BrF2N3S/c16-10-6-5-9(13(18)7-10)8-22-15-19-14(20-21-15)11-3-1-2-4-12(11)17/h1-7H,8H2,(H,19,20,21)