S-(3-((4-((4-(2-((tert-Butoxycarbonyl)(4-hydroxy-3,5-diisopropylbenzyl)amino)acetamido)phenyl)diazenyl)phenyl)amino)-3-oxopropyl) Methanesulfonothioate

Analyte Name

S-(3-((4-((4-(2-((tert-Butoxycarbonyl)(4-hydroxy-3,5-diisopropylbenzyl)amino)acetamido)phenyl)diazenyl)phenyl)amino)-3-oxopropyl) Methanesulfonothioate

Molecular Formula

C36 H47 N5 O7 S2

Molecular Weight

725.918

Accurate Mass

725.292

SMILES

CC(C)c1cc(CN(CC(=O)Nc2ccc(cc2)N=Nc3ccc(NC(=O)CCSS(=O)(=O)C)cc3)C(=O)OC(C)(C)C)cc(C(C)C)c1O

InChI

InChI=1S/C36H47N5O7S2/c1-23(2)30-19-25(20-31(24(3)4)34(30)44)21-41(35(45)48-36(5,6)7)22-33(43)38-27-11-15-29(16-12-27)40-39-28-13-9-26(10-14-28)37-32(42)17-18-49-50(8,46)47/h9-16,19-20,23-24,44H,17-18,21-22H2,1-8H3,(H,37,42)(H,38,43)

IUPAC

tert-butyl N-[[4-hydroxy-3,5-di(propan-2-yl)phenyl]methyl]-N-[2-[4-[[4-(3-methylsulfonylsulfanylpropanoylamino)phenyl]diazenyl]anilino]-2-oxoethyl]carbamate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat