3-[[3,5-bis(2-methylbutan-2-yl)-2-oxidanyl-phenyl]methyl]-1,3-benzothiazole-2-thione

Systemtic Name: 3-[[3,5-bis(2-methylbutan-2-yl)-2-oxidanyl-phenyl]methyl]-1,3-benzothiazole-2-thione Openeye Name: 3-[[3,5-bis(1,1-dimethylpropyl)-2-hydroxy-phenyl]methyl]-1,3-benzothiazole-2-thione CAS Name: 3-[[2-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]methyl]-1,3-benzothiazole-2-thione IUPAC Name: 3-[[2-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]methyl]-1,3-benzothiazole-2-thione Traditional Name: 3-(3,5-ditert-amyl-2-hydroxy-benzyl)-1,3-benzothiazole-2-thione Formula: C24H31NOS2 MolecularWeight: 413.63904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C(=C1)C(C)(C)CC)O)CN2C3=CC=CC=C3SC2=S

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C(=C1)C(C)(C)CC)O)CN2C3=CC=CC=C3SC2=S

InChI

InChI=1S/C24H31NOS2/c1-7-23(3,4)17-13-16(21(26)18(14-17)24(5,6)8-2)15-25-19-11-9-10-12-20(19)28-22(25)27/h9-14,26H,7-8,15H2,1-6H3