2-[(1S,2S)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclohexyl]sulfanyl-N-methyl-N-(2-pyridin-2-ylethyl)ethanamide

Systemtic Name: 2-[(1S,2S)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclohexyl]sulfanyl-N-methyl-N-(2-pyridin-2-ylethyl)ethanamide Openeye Name: 2-[(1S,2S)-2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylcyclohexyl]sulfanyl-N-methyl-N-[2-(2-pyridyl)ethyl]acetamide CAS Name: 2-[[(1S,2S)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]cyclohexyl]thio]-N-methyl-N-[2-(2-pyridinyl)ethyl]acetamide IUPAC Name: 2-[(1S,2S)-2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylcyclohexyl]sulfanyl-N-methyl-N-(2-pyridin-2-ylethyl)acetamide Traditional Name: 2-[[(1S,2S)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]cyclohexyl]thio]-N-methyl-N-[2-(2-pyridyl)ethyl]acetamide Formula: C30H44N2O2S2 MolecularWeight: 528.81256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2CCCCC2SCC(=O)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)S[C@H]2CCCC[C@@H]2SCC(=O)N(C)CCC3=CC=CC=N3

InChI

InChI=1S/C30H44N2O2S2/c1-29(2,3)23-18-22(19-24(28(23)34)30(4,5)6)36-26-14-9-8-13-25(26)35-20-27(33)32(7)17-15-21-12-10-11-16-31-21/h10-12,16,18-19,25-26,34H,8-9,13-15,17,20H2,1-7H3/t25-,26-/m0/s1