Chem
J-GLOBAL ID：201407083992817537   Nikkaji number：J3.304.639A

MP-470

アムバチニブ
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： C23H21N5O3S
Molecular formula furigana： C23-H21-N5-O3-S
Molecular weight： 447.510
InChI： InChI=1S/C23H21N5O3S/c32-23(24-12-15-5-6-18-19(11-15)30-14-29-18)28-9-7-27(8-10-28)22-21-20(25-13-26-22)16-3-1-2-4-17(16)31-21/h1-6,11,13H,7-10,12,14H2,(H,24,32)
InChI key： FOFDIMHVKGYHRU-UHFFFAOYSA-N
SMILES： S=C(NCc1ccc2OCOc2c1)N1CCN(CC1)c1ncnc2c3ccccc3oc12
Systematic name  (3)：
  • N-(1,3-ベンゾジオキソール-5-イルメチル)-4-(ベンゾフロ[3,2-d]ピリミジン-4-イル)ピペラジン-1-カルボチオアミド
  • N-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-4-{8-オキサ-3,5-ジアザトリシクロ[7.4.0.02,7]トリデカ-1(9),2(7),3,5,10,12-ヘキサエン-6-イル}ピペラジン-1-カルボチオアミド
  • N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{8-oxa-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl}piperazine-1-carbothioamide
Other name (4)：
  • N-(1,3-Benzodioxole-5-ylmethyl)-4-(benzofuro[3,2-d]pyrimidine-4-yl)piperazine-1-carbothioamide
  • アムバチニブ
  • Amuvatinib
  • MP-470
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