Chem
J-GLOBAL ID：200907081210010963   Nikkaji number：J32.855C

Altanserin

アルタンセリン
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： C22H22FN3O2S
Molecular formula furigana： C22-H22-F-N3-O2-S
Molecular weight： 411.500
InChI： InChI=1S/C22H22FN3O2S/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)
InChI key： SMYALUSCZJXWHG-UHFFFAOYSA-N
SMILES： Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1
Systematic name  (3)：
  • 3-[2-[4-(4-フルオロベンゾイル)-1-ピペリジニル]エチル]-2,3-ジヒドロ-2-チオキソ-4(1H)-キナゾリノン
  • 3-{2-[4-(4-フルオロベンゾイル)ピペリジン-1-イル]エチル}-2-スルファニリデン-1,2,3,4-テトラヒドロキナゾリン-4-オン
  • 3-{2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one
Other name (3)：
  • アルタンセリン
  • Altanserin
  • 3-[2-[4-(4-Fluorobenzoyl)-1-piperidinyl]ethyl]-2,3-dihydro-2-thioxo-4(1H)-quinazolinone
CAS registry number： 76330-71-7
Regulation number (1)：
  • EINECS2784221
KEGG COMPOUND： C11734
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