Chem
J-GLOBAL ID：200907094858613510   Nikkaji number：J1.042.496H

4-[2-[4-[[(S)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine]-11α-yl]piperidino]-2-oxoethyl]-1-piperidinecarboxamide

4-[2-[4-[[(S)-3,10-ジブロモ-8-クロロ-6,11-ジヒドロ-5H-ベンゾ[5,6]シクロヘプタ[1,2-b]ピリジン]-11α-イル]ピペリジノ]-2-オキソエチル]-1-ピペリジンカルボアミド
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： C27H31Br2ClN4O2
Molecular formula furigana： C27-H31-BR2-CL-N4-O2
Molecular weight： 638.830
InChI： InChI=1S/C27H31Br2ClN4O2/c28-20-12-19-2-1-18-13-21(30)14-22(29)24(18)25(26(19)32-15-20)17-5-9-33(10-6-17)23(35)11-16-3-7-34(8-4-16)27(31)36/h12-17,25H,1-11H2,(H2,31,36)/t25-/m0/s1
InChI key： DHMTURDWPRKSOA-VWLOTQADSA-N
SMILES： NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1
Systematic name  (4)：
  • 4-[2-[4-[[(S)-3,10-ジブロモ-8-クロロ-6,11-ジヒドロ-5H-ベンゾ[5,6]シクロヘプタ[1,2-b]ピリジン]-11α-イル]ピペリジノ]-2-オキソエチル]-1-ピペリジンカルボアミド
  • 4-[2-[4-[[(11S)-3,10-ジブロモ-8-クロロ-6,11-ジヒドロ-5H-ベンゾ[5,6]シクロヘプタ[1,2-b]ピリジン]-11-イル]ピペリジノ]-2-オキソエチル]ピペリジン-1-カルボアミド
  • 4-(2-{4-[(2S)-6,15-ジブロモ-13-クロロ-4-アザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-2-イル]ピペリジン-1-イル}-2-オキソエチル)ピペリジン-1-カルボキサミド
  • 4-(2-{4-[(2S)-6,15-dibromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl]piperidin-1-yl}-2-oxoethyl)piperidine-1-carboxamide
Other name (2)：
  • 4-[2-[4-[[(S)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine]-11α-yl]piperidino]-2-oxoethyl]-1-piperidinecarboxamide
  • 4-[2-[4-[[(11S)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine]-11-yl]piperidino]-2-oxoethyl]piperidine-1-carboxamide
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