Chem
J-GLOBAL ID：201607007562374337   Nikkaji number：J3.470.763D

2-((S)-(2-Thienyl)(Boc-amino)methyl)-1,3-dithiane-2-carboxylic acid benzyl ester

2-((S)-(2-チエニル)(Boc-アミノ)メチル)-1,3-ジチアン-2-カルボン酸ベンジル
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： C22H27NO4S3
Molecular formula furigana： C22-H27-N-O4-S3
Molecular weight： 465.640
InChI： InChI=1S/C22H27NO4S3/c1-21(2,3)27-20(25)23-18(17-11-7-12-28-17)22(29-13-8-14-30-22)19(24)26-15-16-9-5-4-6-10-16/h4-7,9-12,18H,8,13-15H2,1-3H3,(H,23,25)/t18-/m0/s1
InChI key： ZUYVJKHWCJCHNC-SFHVURJKSA-N
SMILES： CC(C)(C)OC(=O)N[C@@H](c1cccs1)C1(SCCCS1)C(=O)OCc1ccccc1
Systematic name  (5)：
  • 2-[(S)-tert-ブトキシカルボニルアミノ(2-チエニル)メチル]-1,3-ジチアン-2-カルボン酸ベンジル
  • 2-((S)-(2-チエニル)(Boc-アミノ)メチル)-1,3-ジチアン-2-カルボン酸ベンジル
  • 2-[(S)-α-[(tert-ブチルオキシカルボニル)アミノ]-2-テニル]-1,3-ジチアン-2-カルボン酸ベンジル
  • ベンジル 2-[(S)-{[(tert-ブトキシ)カルボニル]アミノ}(チオフェン-2-イル)メチル]-1,3-ジチアン-2-カルボキシラート
  • benzyl 2-[(S)-{[(tert-butoxy)carbonyl]amino}(thiophen-2-yl)methyl]-1,3-dithiane-2-carboxylate
Other name (3)：
  • 2-[(S)-tert-Butoxycarbonylamino(2-thienyl)methyl]-1,3-dithiane-2-carboxylic acid benzyl ester
  • 2-((S)-(2-Thienyl)(Boc-amino)methyl)-1,3-dithiane-2-carboxylic acid benzyl ester
  • 2-[(S)-α-[(tert-Butyloxycarbonyl)amino]-2-thenyl]-1,3-dithiane-2-carboxylic acid benzyl ester
Thsaurus map：
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