3-[(4-bromanyl-2-tert-butyl-phenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-bromanyl-2-tert-butyl-phenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-bromo-2-tert-butyl-phenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-bromo-2-tert-butylphenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-bromo-2-tert-butylphenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-bromo-2-tert-butyl-phenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C15H20BrN3OS MolecularWeight: 370.3078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CCN1C(=NNC1=S)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C15H20BrN3OS/c1-5-19-13(17-18-14(19)21)9-20-12-7-6-10(16)8-11(12)15(2,3)4/h6-8H,5,9H2,1-4H3,(H,18,21)