Chem
J-GLOBAL ID：200907043382474547   Nikkaji number：J2.583.420H

N-[(S)-Fluorocyano(4-methylphenyl)acetyl]-L-methionine methyl ester

N-[(S)-フルオロシアノ(4-メチルフェニル)アセチル]-L-メチオニンメチル
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： C16H19FN2O3S
Molecular formula furigana： C16-H19-F-N2-O3-S
Molecular weight： 338.400
InChI： InChI=1S/C16H19FN2O3S/c1-11-4-6-12(7-5-11)16(17,10-18)15(21)19-13(8-9-23-3)14(20)22-2/h4-7,13H,8-9H2,1-3H3,(H,19,21)/t13-,16+/m0/s1
InChI key： MDFSYCFKQUXWPX-XJKSGUPXSA-N
SMILES： COC(=O)[C@H](CCSC)NC(=O)[C@@](F)(C#N)c1ccc(C)cc1
Systematic name  (3)：
  • N-[(S)-フルオロシアノ(4-メチルフェニル)アセチル]-L-メチオニンメチル
  • メチル (2S)-2-[(2S)-2-シアノ-2-フルオロ-2-(4-メチルフェニル)アセトアミド]-4-(メチルスルファニル)ブタノアート
  • methyl (2S)-2-[(2S)-2-cyano-2-fluoro-2-(4-methylphenyl)acetamido]-4-(methylsulfanyl)butanoate
Other name (1)：
  • N-[(S)-Fluorocyano(4-methylphenyl)acetyl]-L-methionine methyl ester
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