Chem
J-GLOBAL ID:200907084114381950   Nikkaji number:J1.404.079J

(2R,3R)-1-(1H-1,2,4-Triazole-1-yl)-2-(2,4-difluorophenyl)-3-(2,2-diethoxyethylamino)-2-butanol

(2R,3R)-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-(2,2-ジエトキシエチルアミノ)-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: C18H26F2N4O3
Molecular formula furigana: C18-H26-F2-N4-O3
Molecular weight: 384.428
InChI: InChI=1S/C18H26F2N4O3/c1-4-26-17(27-5-2)9-22-13(3)18(25,10-24-12-21-11-23-24)15-7-6-14(19)8-16(15)20/h6-8,11-13,17,22,25H,4-5,9-10H2,1-3H3/t13-,18-/m1/s1
InChI key: PTGOQNHEXNJNBH-FZKQIMNGSA-N
SMILES: CCOC(CN[C@H](C)[C@](O)(Cn1cncn1)c1ccc(F)cc1F)OCC
Systematic name  (3):
  • (2R,3R)-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-(2,2-ジエトキシエチルアミノ)-2-ブタノール
  • (2R,3R)-3-[(2,2-ジエトキシエチル)アミノ]-2-(2,4-ジフルオロフェニル)-1-(1H-1,2,4-トリアゾール-1-イル)ブタン-2-オール
  • (2R,3R)-3-[(2,2-diethoxyethyl)amino]-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
Other name (1):
  • (2R,3R)-1-(1H-1,2,4-Triazole-1-yl)-2-(2,4-difluorophenyl)-3-(2,2-diethoxyethylamino)-2-butanol
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