Chem
J-GLOBAL ID：200907044358128588   Nikkaji number：J765.579G

GR-205171

GR-205171
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： C21H23F3N6O
Molecular formula furigana： C21-H23-F3-N6-O
Molecular weight： 432.451
InChI： InChI=1S/C21H23F3N6O/c1-31-18-10-9-16(30-20(21(22,23)24)27-28-29-30)12-15(18)13-26-17-8-5-11-25-19(17)14-6-3-2-4-7-14/h2-4,6-7,9-10,12,17,19,25-26H,5,8,11,13H2,1H3/t17-,19-/m0/s1
InChI key： XILNRORTJVDYRH-HKUYNNGSSA-N
SMILES： COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F
Systematic name  (4)：
  • (2S,3S)-N-[2-メトキシ-5-[5-(トリフルオロメチル)-1H-テトラゾール-1-イル]ベンジル]-2-フェニル-3-ピペリジンアミン
  • (2S,3S)-3-[2-メトキシ-5-(5-トリフルオロメチル-1H-テトラゾール-1-イル)ベンジルアミノ]-2-フェニルピペリジン
  • (2S,3S)-N-({2-メトキシ-5-[5-(トリフルオロメチル)-1H-1,2,3,4-テトラゾール-1-イル]フェニル}メチル)-2-フェニルピペリジン-3-アミン
  • (2S,3S)-N-({2-methoxy-5-[5-(trifluoromethyl)-1H-1,2,3,4-tetrazol-1-yl]phenyl}methyl)-2-phenylpiperidin-3-amine
Other name (4)：
  • GR-205171
  • (2S,3S)-N-[2-Methoxy-5-[5-(trifluoromethyl)-1H-tetrazol-1-yl]benzyl]-2-phenyl-3-piperidinamine
  • (2S,3S)-3-[2-Methoxy-5-(5-trifluoromethyl-1H-tetrazole-1-yl)benzylamino]-2-phenylpiperidine
  • GR205171
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