Chem
J-GLOBAL ID：200907054696586724   Nikkaji number：J22.986E

LY-171883

LY-171883
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： C16H22N4O3
Molecular formula furigana： C16-H22-N4-O3
Molecular weight： 318.377
InChI： InChI=1S/C16H22N4O3/c1-3-6-13-14(9-8-12(11(2)21)16(13)22)23-10-5-4-7-15-17-19-20-18-15/h8-9,22H,3-7,10H2,1-2H3,(H,17,18,19,20)
InChI key： MWYHLEQJTQJHSS-UHFFFAOYSA-N
SMILES： CCCc1c(OCCCCc2nnn[nH]2)ccc(C(=O)C)c1O
Systematic name  (3)：
  • 1-[2-ヒドロキシ-3-プロピル-4-[4-(1H-テトラゾール-5-イル)ブトキシ]フェニル]エタノン
  • 1-{2-ヒドロキシ-3-プロピル-4-[4-(1H-1,2,3,4-テトラゾール-5-イル)ブトキシ]フェニル}エタン-1-オン
  • 1-{2-hydroxy-3-propyl-4-[4-(1H-1,2,3,4-tetrazol-5-yl)butoxy]phenyl}ethan-1-one
Other name (5)：
  • LY-171883
  • 1-[2-Hydroxy-3-propyl-4-[4-(1H-tetrazol-5-yl)butoxy]phenyl]ethanone
  • トメルカスト
  • S-1414
  • Tomelukast
CAS registry number： 88107-10-2
KEGG DRUG： D02851
Application (1)：
leukotriene antagonist
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