Chem
J-GLOBAL ID：201407095395154452   Nikkaji number：J3.275.802I

[4α-[4-[2-(Trifluoromethyl)-4-quinolinyl]piperazino]pyrrolidine-2α-yl](thiazolidine-3-yl) ketone

[4α-[4-[2-(トリフルオロメチル)-4-キノリニル]ピペラジノ]ピロリジン-2α-イル](チアゾリジン-3-イル)ケトン
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： C22H26F3N5OS
Molecular formula furigana： C22-H26-F3-N5-O-S
Molecular weight： 465.540
InChI： InChI=1S/C22H26F3N5OS/c23-22(24,25)20-12-19(16-3-1-2-4-17(16)27-20)29-7-5-28(6-8-29)15-11-18(26-13-15)21(31)30-9-10-32-14-30/h1-4,12,15,18,26H,5-11,13-14H2/t15-,18-/m0/s1
InChI key： JWKZKADFQDTDIU-YJBOKZPZSA-N
SMILES： FC(F)(F)c1cc(N2CCN(CC2)[C@@H]2CN[C@@H](C2)C(=O)N2CCSC2)c2ccccc2n1
Systematic name  (3)：
  • [4α-[4-[2-(トリフルオロメチル)-4-キノリニル]ピペラジノ]ピロリジン-2α-イル](チアゾリジン-3-イル)ケトン
  • 4-{4-[(3S,5S)-5-(1,3-チアゾリジン-3-カルボニル)ピロリジン-3-イル]ピペラジン-1-イル}-2-(トリフルオロメチル)キノリン
  • 4-{4-[(3S,5S)-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl}-2-(trifluoromethyl)quinoline
Other name (1)：
  • [4α-[4-[2-(Trifluoromethyl)-4-quinolinyl]piperazino]pyrrolidine-2α-yl](thiazolidine-3-yl) ketone
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