Chem
J-GLOBAL ID：200907035914303590   Nikkaji number：J2.048.725I

Azietomidate

アジエトミダート
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： C16H18N4O2
Molecular formula furigana： C16-H18-N4-O2
Molecular weight： 298.346
InChI： InChI=1S/C16H18N4O2/c1-12(13-6-4-3-5-7-13)20-11-17-10-14(20)15(21)22-9-8-16(2)18-19-16/h3-7,10-12H,8-9H2,1-2H3/t12-/m1/s1
InChI key： DUOHNSBKYJHAMQ-GFCCVEGCSA-N
SMILES： C[C@H](c1ccccc1)n1cncc1C(=O)OCCC1(C)N=N1
Systematic name  (3)：
  • 1-[(R)-α-メチルベンジル]-1H-イミダゾール-5-カルボン酸2-(3-メチル-3H-ジアジリン-3-イル)エチル
  • 2-(3-メチル-3H-ジアジリン-3-イル)エチル 1-[(1R)-1-フェニルエチル]-1H-イミダゾール-5-カルボキシラート
  • 2-(3-methyl-3H-diazirin-3-yl)ethyl 1-[(1R)-1-phenylethyl]-1H-imidazole-5-carboxylate
Other name (3)：
  • 1-[(R)-α-Methylbenzyl]-1H-imidazole-5-carboxylic acid 2-(3-methyl-3H-diazirine-3-yl)ethyl ester
  • アジエトミダート
  • Azietomidate
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