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

Systemtic Name: 3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-1H-1,2,4-triazole-5-thione Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=NNC(=S)N2CC=C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=NNC(=S)N2CC=C

InChI

InChI=1S/C21H31N3OS/c1-8-11-24-17(22-23-19(24)26)10-9-14-12-15(20(2,3)4)18(25)16(13-14)21(5,6)7/h8,12-13,25H,1,9-11H2,2-7H3,(H,23,26)