3-(3-bromanyl-4-fluoranyl-phenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-bromo-4-fluorophenyl)-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-bromo-4-fluorophenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C13H9BrFN3OS MolecularWeight: 354.197463

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NNC2=S)C3=CC(=C(C=C3)F)Br

Isomeric SMILES

C1=COC(=C1)CN2C(=NNC2=S)C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C13H9BrFN3OS/c14-10-6-8(3-4-11(10)15)12-16-17-13(20)18(12)7-9-2-1-5-19-9/h1-6H,7H2,(H,17,20)