Chem
J-GLOBAL ID：200907019983146751   Nikkaji number：J1.035.214B

L-796325

5-(トリフルオロメチル)-1-[3-[[(2α-フェニルピペリジン-3α-イル)アミノ]メチル]-4-メトキシフェニル]-1H-テトラゾール
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： 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-/m1/s1
InChI key： XILNRORTJVDYRH-IEBWSBKVSA-N
SMILES： COc1ccc(cc1CN[C@@H]1CCCN[C@@H]1c1ccccc1)n1nnnc1C(F)(F)F
Systematic name  (3)：
  • 5-(トリフルオロメチル)-1-[3-[[(2α-フェニルピペリジン-3α-イル)アミノ]メチル]-4-メトキシフェニル]-1H-テトラゾール
  • (2R,3R)-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
  • (2R,3R)-N-({2-methoxy-5-[5-(trifluoromethyl)-1H-1,2,3,4-tetrazol-1-yl]phenyl}methyl)-2-phenylpiperidin-3-amine
Other name (2)：
  • 5-(Trifluoromethyl)-1-[3-[[(2α-phenylpiperidine-3α-yl)amino]methyl]-4-methoxyphenyl]-1H-tetrazole
  • L-796325
Thsaurus map：
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