6-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-oxidanyl-N-(phenylmethyl)hexanethioamide

Systemtic Name: 6-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-oxidanyl-N-(phenylmethyl)hexanethioamide Openeye Name: N-benzyl-6-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-hydroxy-hexanethioamide CAS Name: 6-(3,5-ditert-butyl-4-hydroxyphenyl)-N-hydroxy-N-(phenylmethyl)hexanethioamide IUPAC Name: N-benzyl-6-(3,5-ditert-butyl-4-hydroxyphenyl)-N-hydroxyhexanethioamide Traditional Name: N-benzyl-6-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-hydroxy-hexanethioamide Formula: C27H39NO2S MolecularWeight: 441.66906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCC(=S)N(CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCC(=S)N(CC2=CC=CC=C2)O

InChI

InChI=1S/C27H39NO2S/c1-26(2,3)22-17-21(18-23(25(22)29)27(4,5)6)15-11-8-12-16-24(31)28(30)19-20-13-9-7-10-14-20/h7,9-10,13-14,17-18,29-30H,8,11-12,15-16,19H2,1-6H3