Chem
J-GLOBAL ID：200907032755805270   Nikkaji number：J22.782J

Emopamil

エモパミル
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： C23H30N2
Molecular formula furigana： C23-H30-N2
Molecular weight： 334.507
InChI： InChI=1S/C23H30N2/c1-20(2)23(19-24,22-13-8-5-9-14-22)16-10-17-25(3)18-15-21-11-6-4-7-12-21/h4-9,11-14,20H,10,15-18H2,1-3H3
InChI key： DWAWDSVKAUWFHC-UHFFFAOYSA-N
SMILES： CC(C)C(CCCN(C)CCc1ccccc1)(C#N)c1ccccc1
Systematic name  (3)：
  • α-(1-メチルエチル)-α-[3-[メチル(2-フェニルエチル)アミノ]プロピル]ベンゼンアセトニトリル
  • 5-[メチル(2-フェニルエチル)アミノ]-2-フェニル-2-(プロパン-2-イル)ペンタンニトリル
  • 5-[methyl(2-phenylethyl)amino]-2-phenyl-2-(propan-2-yl)pentanenitrile
Other name (4)：
  • エモパミル
  • Emopamil
  • Sz-45
  • α-(1-Methylethyl)-α-[3-[methyl(2-phenylethyl)amino]propyl]benzeneacetonitrile
CAS registry number： 78370-13-5
KEGG COMPOUND： C13766
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