4-(4-oxidanylbutyl)-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-oxidanylbutyl)-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-hydroxybutyl)-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-hydroxybutyl)-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-hydroxybutyl)-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-hydroxybutyl)-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=S)N2CCCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=S)N2CCCCO

InChI

InChI=1S/C12H15N3OS/c16-9-5-4-8-15-11(13-14-12(15)17)10-6-2-1-3-7-10/h1-3,6-7,16H,4-5,8-9H2,(H,14,17)