Chem
J-GLOBAL ID：200907092213969635   Nikkaji number：J807.019I

3,3′-[Trimethylenebis(tert-butoxycarbonylimino)]bis(propanethioamide)

3,3′-[トリメチレンビス(tert-ブトキシカルボニルイミノ)]ビス(プロパンチオアミド)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C19H36N4O4S2
Molecular formula furigana： C19-H36-N4-O4-S2
Molecular weight： 448.640
InChI： InChI=1S/C19H36N4O4S2/c1-18(2,3)26-16(24)22(12-8-14(20)28)10-7-11-23(13-9-15(21)29)17(25)27-19(4,5)6/h7-13H2,1-6H3,(H2,20,28)(H2,21,29)
InChI key： WCYJOSPMKNWDPR-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)N(CCCN(CCC(=S)N)C(=O)OC(C)(C)C)CCC(=S)N
Systematic name  (3)：
  • 3,3′-[トリメチレンビス(tert-ブトキシカルボニルイミノ)]ビス(プロパンチオアミド)
  • tert-ブチル N-(3-{[(tert-ブトキシ)カルボニル](2-カルバモチオイルエチル)アミノ}プロピル)-N-(2-カルバモチオイルエチル)カルバマート
  • tert-butyl N-(3-{[(tert-butoxy)carbonyl](2-carbamothioylethyl)amino}propyl)-N-(2-carbamothioylethyl)carbamate
Other name (1)：
  • 3,3′-[Trimethylenebis(tert-butoxycarbonylimino)]bis(propanethioamide)
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