Chem
J-GLOBAL ID：200907040995942560   Nikkaji number：J404.515G

4-Phenylthiocaptopril

4-フェニルチオカプトプリル
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： C15H19NO3S2
Molecular formula furigana： C15-H19-N-O3-S2
Molecular weight： 325.440
InChI： InChI=1S/C15H19NO3S2/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)21-11-5-3-2-4-6-11/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1
InChI key： UQWLOWFDKAFKAP-WXHSDQCUSA-N
SMILES： C[C@H](CS)C(=O)N1C[C@H](C[C@H]1C(=O)O)Sc1ccccc1
Systematic name  (4)：
  • (2S)-1-[(S)-3-メルカプト-2-メチルプロパノイル]-4α-フェニルチオピロリジン-2α-カルボン酸
  • (2S)-1-[(S)-3-メルカプト-2-メチル-1-オキソプロピル]-4α-フェニルチオ-L-プロリン
  • (2S,4S)-1-[(2S)-2-メチル-3-スルファニルプロパノイル]-4-(フェニルスルファニル)ピロリジン-2-カルボン酸
  • (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)pyrrolidine-2-carboxylic acid
Other name (4)：
  • (2S)-1-[(S)-3-Mercapto-2-methyl-1-oxopropyl]-4α-phenylthio-L-proline
  • (2S)-1-[(S)-3-Mercapto-2-methylpropanoyl]-4α-phenylthiopyrrolidine-2α-carboxylic acid
  • 4-フェニルチオカプトプリル
  • 4-Phenylthiocaptopril
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