Chem
J-GLOBAL ID：200907034551354492   Nikkaji number：J22.910E

Tiospirone

チオスピロン
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： C24H32N4O2S
Molecular formula furigana： C24-H32-N4-O2-S
Molecular weight： 440.610
InChI： InChI=1S/C24H32N4O2S/c29-21-17-24(9-3-4-10-24)18-22(30)28(21)12-6-5-11-26-13-15-27(16-14-26)23-19-7-1-2-8-20(19)31-25-23/h1-2,7-8H,3-6,9-18H2
InChI key： ZFZPJDFBJFHYIV-UHFFFAOYSA-N
SMILES： O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Systematic name  (3)：
  • 8-[4-[4-(1,2-ベンゾイソチアゾール-3-イル)-1-ピペラジニル]ブチル]-8-アザスピロ[4.5]デカン-7,9-ジオン
  • 8-{4-[4-(1,2-ベンゾチアゾール-3-イル)ピペラジン-1-イル]ブチル}-8-アザスピロ[4.5]デカン-7,9-ジオン
  • 8-{4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl}-8-azaspiro[4.5]decane-7,9-dione
Other name (4)：
  • MJ-13859
  • 8-[4-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione
  • Tiospirone
  • チオスピロン
CAS registry number： 87691-91-6
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