3-[(4-tert-butylphenoxy)methyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-tert-butylphenoxy)methyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-tert-butylphenoxy)methyl]-4-isobutyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-tert-butylphenoxy)methyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-tert-butylphenoxy)methyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-tert-butylphenoxy)methyl]-4-isobutyl-1H-1,2,4-triazole-5-thione Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NNC1=S)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)CN1C(=NNC1=S)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C17H25N3OS/c1-12(2)10-20-15(18-19-16(20)22)11-21-14-8-6-13(7-9-14)17(3,4)5/h6-9,12H,10-11H2,1-5H3,(H,19,22)