Chem
J-GLOBAL ID：200907001471878126   Nikkaji number：J1.186.538K

(2S,3S)-1-(1H-1,2,4-Triazole-1-yl)-2-(2,4-difluorophenyl)-3-(methyl-2-propynylamino)-2-butanol

(2S,3S)-1-(1H-1,2,4-トリアゾール-1-イル)-2-(2,4-ジフルオロフェニル)-3-(メチル-2-プロピニルアミノ)-2-ブタノール
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： C16H18F2N4O
Molecular formula furigana： C16-H18-F2-N4-O
Molecular weight： 320.344
InChI： InChI=1S/C16H18F2N4O/c1-4-7-21(3)12(2)16(23,9-22-11-19-10-20-22)14-6-5-13(17)8-15(14)18/h1,5-6,8,10-12,23H,7,9H2,2-3H3/t12-,16-/m0/s1
InChI key： QHRZCJDDCGUTSW-LRDDRELGSA-N
SMILES： C[C@H](N(C)CC#C)[C@@](O)(Cn1cncn1)c1ccc(F)cc1F
Systematic name  (3)：
  • (2S,3S)-1-(1H-1,2,4-トリアゾール-1-イル)-2-(2,4-ジフルオロフェニル)-3-(メチル-2-プロピニルアミノ)-2-ブタノール
  • (2S,3S)-2-(2,4-ジフルオロフェニル)-3-[メチル(プロパ-2-イン-1-イル)アミノ]-1-(1H-1,2,4-トリアゾール-1-イル)ブタン-2-オール
  • (2S,3S)-2-(2,4-difluorophenyl)-3-[methyl(prop-2-yn-1-yl)amino]-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
Other name (1)：
  • (2S,3S)-1-(1H-1,2,4-Triazole-1-yl)-2-(2,4-difluorophenyl)-3-(methyl-2-propynylamino)-2-butanol
Thsaurus map：
Thesaurus Map

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