Chem
J-GLOBAL ID：200907027904027931   Nikkaji number：J1.749.942D

(2R,3S)-2-(tert-Butylthio)-3-[(4-methoxyphenyl)amino]-4,4,4-trifluorobutanoic acid tert-butyl ester

(2R,3S)-2-(tert-ブチルチオ)-3-[(4-メトキシフェニル)アミノ]-4,4,4-トリフルオロブタン酸tert-ブチル
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： C19H28F3NO3S
Molecular formula furigana： C19-H28-F3-N-O3-S
Molecular weight： 407.490
InChI： InChI=1S/C19H28F3NO3S/c1-17(2,3)26-16(24)14(27-18(4,5)6)15(19(20,21)22)23-12-8-10-13(25-7)11-9-12/h8-11,14-15,23H,1-7H3/t14-,15-/m1/s1
InChI key： BINLONANRBCAOM-HUUCEWRRSA-N
SMILES： COc1ccc(N[C@H]([C@@H](SC(C)(C)C)C(=O)OC(C)(C)C)C(F)(F)F)cc1
Systematic name  (3)：
  • (2R,3S)-2-(tert-ブチルチオ)-3-[(4-メトキシフェニル)アミノ]-4,4,4-トリフルオロブタン酸tert-ブチル
  • tert-ブチル (2R,3S)-2-(tert-ブチルスルファニル)-4,4,4-トリフルオロ-3-[(4-メトキシフェニル)アミノ]ブタノアート
  • tert-butyl (2R,3S)-2-(tert-butylsulfanyl)-4,4,4-trifluoro-3-[(4-methoxyphenyl)amino]butanoate
Other name (1)：
  • (2R,3S)-2-(tert-Butylthio)-3-[(4-methoxyphenyl)amino]-4,4,4-trifluorobutanoic acid tert-butyl ester
Thsaurus map：
Thesaurus Map

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