4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-butyl-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Formula: C12H14FN3S MolecularWeight: 251.323063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NNC1=S)C2=CC=CC=C2F

Isomeric SMILES

CCCCN1C(=NNC1=S)C2=CC=CC=C2F

InChI

InChI=1S/C12H14FN3S/c1-2-3-8-16-11(14-15-12(16)17)9-6-4-5-7-10(9)13/h4-7H,2-3,8H2,1H3,(H,15,17)