Chem
J-GLOBAL ID：200907095381948448   Nikkaji number：J1.774.562J

1-(2-Azabicyclo[2.2.2]octane-2-yl)-2-methyl-2-[2-(3,5-dimethylphenyl)-3-[(S)-1-methyl-2-[2-(4-pyridyl)ethylamino]ethyl]-1H-indole-5-yl]-1-propanone

1-(2-アザビシクロ[2.2.2]オクタン-2-イル)-2-メチル-2-[2-(3,5-ジメチルフェニル)-3-[(S)-1-メチル-2-[2-(4-ピリジル)エチルアミノ]エチル]-1H-インドール-5-イル]-1-プロパノン
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： C37H46N4O
Molecular formula furigana： C37-H46-N4-O
Molecular weight： 562.802
InChI： InChI=1S/C37H46N4O/c1-24-18-25(2)20-29(19-24)35-34(26(3)22-39-17-14-27-12-15-38-16-13-27)32-21-30(8-11-33(32)40-35)37(4,5)36(42)41-23-28-6-9-31(41)10-7-28/h8,11-13,15-16,18-21,26,28,31,39-40H,6-7,9-10,14,17,22-23H2,1-5H3/t26-,28?,31?/m1/s1
InChI key： GGVFLXSCFPVLMS-WPCLDFDBSA-N
SMILES： C[C@H](CNCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)c1cc(C)cc(C)c1
Systematic name  (4)：
  • 1-(2-アザビシクロ[2.2.2]オクタン-2-イル)-2-メチル-2-[2-(3,5-ジメチルフェニル)-3-[(1S)-1-メチル-2-[2-(4-ピリジル)エチルアミノ]エチル]-1H-インドール-5-イル]-1-プロパノン
  • 1-(2-アザビシクロ[2.2.2]オクタン-2-イル)-2-メチル-2-[2-(3,5-ジメチルフェニル)-3-[(S)-1-メチル-2-[2-(4-ピリジル)エチルアミノ]エチル]-1H-インドール-5-イル]-1-プロパノン
  • 1-{2-アザビシクロ[2.2.2]オクタン-2-イル}-2-[2-(3,5-ジメチルフェニル)-3-[(2S)-1-{[2-(ピリジン-4-イル)エチル]アミノ}プロパン-2-イル]-1H-インドール-5-イル]-2-メチルプロパン-1-オン
  • 1-{2-azabicyclo[2.2.2]octan-2-yl}-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-{[2-(pyridin-4-yl)ethyl]amino}propan-2-yl]-1H-indol-5-yl]-2-methylpropan-1-one
Other name (2)：
  • 1-(2-Azabicyclo[2.2.2]octane-2-yl)-2-methyl-2-[2-(3,5-dimethylphenyl)-3-[(1S)-1-methyl-2-[2-(4-pyridyl)ethylamino]ethyl]-1H-indole-5-yl]-1-propanone
  • 1-(2-Azabicyclo[2.2.2]octane-2-yl)-2-methyl-2-[2-(3,5-dimethylphenyl)-3-[(S)-1-methyl-2-[2-(4-pyridyl)ethylamino]ethyl]-1H-indole-5-yl]-1-propanone
Thsaurus map：
Thesaurus Map

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