Chem
J-GLOBAL ID：200907059096453528   Nikkaji number：J1.060.504K

XR-9576

XR-9576
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： C38H38N4O6
Molecular formula furigana： C38-H38-N4-O6
Molecular weight： 646.744
InChI： InChI=1S/C38H38N4O6/c1-45-33-18-25-14-16-42(23-28(25)19-34(33)46-2)15-13-24-9-11-29(12-10-24)40-38(44)30-20-35(47-3)36(48-4)21-32(30)41-37(43)27-17-26-7-5-6-8-31(26)39-22-27/h5-12,17-22H,13-16,23H2,1-4H3,(H,40,44)(H,41,43)
InChI key： LGGHDPFKSSRQNS-UHFFFAOYSA-N
SMILES： COc1cc2CCN(CCc3ccc(NC(=O)c4cc(OC)c(OC)cc4NC(=O)c4cnc5ccccc5c4)cc3)Cc2cc1OC
Systematic name  (4)：
  • N-[4-[2-(6,7-ジメトキシ-1,2,3,4-テトラヒドロイソキノリン-2-イル)エチル]フェニル]-2-(キノリン-3-イルカルボニルアミノ)-4,5-ジメトキシベンズアミド
  • N-[2-[[4-[2-[6,7-ジメトキシ-3,4-ジヒドロイソキノリン-2(1H)-イル]エチル]フェニル]カルバモイル]-4,5-ジメトキシフェニル]-3-キノリンカルボアミド
  • N-[2-({4-[2-(6,7-ジメトキシ-1,2,3,4-テトラヒドロイソキノリン-2-イル)エチル]フェニル}カルバモイル)-4,5-ジメトキシフェニル]キノリン-3-カルボキサミド
  • N-[2-({4-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]phenyl}carbamoyl)-4,5-dimethoxyphenyl]quinoline-3-carboxamide
Other name (7)：
  • N-[4-[2-(6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline-2-yl)ethyl]phenyl]-2-(quinoline-3-ylcarbonylamino)-4,5-dimethoxybenzamide
  • XR-9576
  • N-[2-[[4-[2-[6,7-Dimethoxy-3,4-dihydroisoquinoline-2(1H)-yl]ethyl]phenyl]carbamoyl]-4,5-dimethoxyphenyl]-3-quinolinecarboxamide
  • Tariquidar
  • タリキダール
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CAS registry number： 206873-63-4
KEGG DRUG： D06008
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