Chem
J-GLOBAL ID:200907021463882786   Nikkaji number:J943.175F

Terbogrel

テルボグレル
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: C23H27N5O2
Molecular formula furigana: C23-H27-N5-O2
Molecular weight: 405.502
InChI: InChI=1S/C23H27N5O2/c1-23(2,3)28-22(26-16-24)27-19-10-6-8-17(14-19)20(11-4-5-12-21(29)30)18-9-7-13-25-15-18/h6-11,13-15H,4-5,12H2,1-3H3,(H,29,30)(H2,26,27,28)/b20-11+
InChI key: XUTLOCQNGLJNSA-RGVLZGJSSA-N
SMILES: CC(C)(C)NC(=Nc1cccc(c1)/C(=C\CCCC(=O)O)/c1cccnc1)NC#N
Systematic name  (4):
  • (E)-6-[3-[[(シアノアミノ)(tert-ブチルアミノ)メチレン]アミノ]フェニル]-6-(3-ピリジル)-5-ヘキセン酸
  • (5E)-6-[3-(2-シアノ-3-tert-ブチルグアニジノ)フェニル]-6-(3-ピリジル)-5-ヘキセン酸
  • (5E)-6-(3-{[(tert-ブチルアミノ)(シアノアミノ)メチリデン]アミノ}フェニル)-6-(ピリジン-3-イル)ヘキサ-5-エン酸
  • (5E)-6-(3-{[(tert-butylamino)(cyanoamino)methylidene]amino}phenyl)-6-(pyridin-3-yl)hex-5-enoic acid
Other name (4):
  • テルボグレル
  • Terbogrel
  • (E)-6-[3-[[(Cyanoamino)(tert-butylamino)methylene]amino]phenyl]-6-(3-pyridyl)-5-hexenoic acid
  • (5E)-6-[3-(2-Cyano-3-tert-butylguanidino)phenyl]-6-(3-pyridyl)-5-hexenoic acid
CAS registry number: 149979-74-8
KEGG DRUG: D06077
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