Chem
J-GLOBAL ID：200907078056502946   Nikkaji number：J1.801.902G

2-Amino-3-(4-methylphenylthio)propanoic acid benzyl ester

2-アミノ-3-(4-メチルフェニルチオ)プロパン酸ベンジル
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： C17H19NO2S
Molecular formula furigana： C17-H19-N-O2-S
Molecular weight： 301.400
InChI： InChI=1S/C17H19NO2S/c1-13-7-9-15(10-8-13)21-12-16(18)17(19)20-11-14-5-3-2-4-6-14/h2-10,16H,11-12,18H2,1H3
InChI key： QWOYMEIOWGTIGJ-UHFFFAOYSA-N
SMILES： Cc1ccc(SCC(N)C(=O)OCc2ccccc2)cc1
Systematic name  (3)：
  • 2-アミノ-3-(4-メチルフェニルチオ)プロパン酸ベンジル
  • ベンジル 2-アミノ-3-[(4-メチルフェニル)スルファニル]プロパノアート
  • benzyl 2-amino-3-[(4-methylphenyl)sulfanyl]propanoate
Other name (1)：
  • 2-Amino-3-(4-methylphenylthio)propanoic acid benzyl ester
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