3-[(2-fluoranylphenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-fluoranylphenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-fluorophenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-fluorophenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-fluorophenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2-fluorophenoxy)methyl]-4-hexyl-1H-1,2,4-triazole-5-thione Formula: C15H20FN3OS MolecularWeight: 309.402203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NNC1=S)COC2=CC=CC=C2F

Isomeric SMILES

CCCCCCN1C(=NNC1=S)COC2=CC=CC=C2F

InChI

InChI=1S/C15H20FN3OS/c1-2-3-4-7-10-19-14(17-18-15(19)21)11-20-13-9-6-5-8-12(13)16/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,18,21)