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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NNC1=S)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CN1C(=NNC1=S)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H14FN3S/c1-8(2)7-16-11(14-15-12(16)17)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3,(H,15,17)