3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C24H31N3OS MolecularWeight: 409.58744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C24H31N3OS/c1-23(2,3)18-14-16(15-19(21(18)28)24(4,5)6)12-13-20-25-26-22(29)27(20)17-10-8-7-9-11-17/h7-11,14-15,28H,12-13H2,1-6H3,(H,26,29)