Chem
J-GLOBAL ID：200907014813359031   Nikkaji number：J8.896J

44106

トキジン
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： C23H29N5O
Molecular formula furigana： C23-H29-N5-O
Molecular weight： 391.519
InChI： InChI=1S/C23H29N5O/c1-5-27-12-16-10-21-19(18-7-6-8-20(27)22(16)18)11-17(13-26(21)4)24-23(29)28-15(3)9-14(2)25-28/h6-9,12,17,19,21H,5,10-11,13H2,1-4H3,(H,24,29)
InChI key： ZSJNNQSQILSGMP-UHFFFAOYSA-N
SMILES： CCn1cc2CC3C(CC(CN3C)NC(=O)n3nc(C)cc3C)c3cccc1c23
Systematic name  (3)：
  • N-(4-エチル-4,6,6a,7,8,9,10,10a-オクタヒドロ-7-メチルインドロ[4,3-fg]キノリン-9-イル)-3,5-ジメチル-1H-ピラゾール-1-カルボアミド
  • N-{11-エチル-6-メチル-6,11-ジアザテトラシクロ[7.6.1.02,7.012,16]ヘキサデカ-1(16),9,12,14-テトラエン-4-イル}-3,5-ジメチル-1H-ピラゾール-1-カルボキサミド
  • N-{11-ethyl-6-methyl-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraen-4-yl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
Other name (4)：
  • トキジン
  • 44106
  • Toquizine
  • N-(4-Ethyl-4,6,6a,7,8,9,10,10a-octahydro-7-methylindolo[4,3-fg]quinolin-9-yl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
CAS registry number： 7125-71-5
KEGG DRUG： D06192
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