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

Systemtic Name: 3-[[3-butan-2-yl-5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]methyl]-1,3-benzothiazole-2-thione Openeye Name: 3-[[5-(1,1-dimethylpropyl)-2-hydroxy-3-sec-butyl-phenyl]methyl]-1,3-benzothiazole-2-thione CAS Name: 3-[[3-butan-2-yl-2-hydroxy-5-(2-methylbutan-2-yl)phenyl]methyl]-1,3-benzothiazole-2-thione IUPAC Name: 3-[[3-butan-2-yl-2-hydroxy-5-(2-methylbutan-2-yl)phenyl]methyl]-1,3-benzothiazole-2-thione Traditional Name: 3-(5-tert-amyl-2-hydroxy-3-sec-butyl-benzyl)-1,3-benzothiazole-2-thione Formula: C23H29NOS2 MolecularWeight: 399.61246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=CC(=C1O)CN2C3=CC=CC=C3SC2=S)C(C)(C)CC

Isomeric SMILES

CCC(C)C1=CC(=CC(=C1O)CN2C3=CC=CC=C3SC2=S)C(C)(C)CC

InChI

InChI=1S/C23H29NOS2/c1-6-15(3)18-13-17(23(4,5)7-2)12-16(21(18)25)14-24-19-10-8-9-11-20(19)27-22(24)26/h8-13,15,25H,6-7,14H2,1-5H3