Chem
J-GLOBAL ID:200907049761162658   Nikkaji number:J379.102E

4-[4-(4-Nitrophenyl)-1-piperazinyl]-N-[(6,11-dihydrodibenzo[b,e]thiepin)-11-yl]butyramide

4-[4-(4-ニトロフェニル)-1-ピペラジニル]-N-[(6,11-ジヒドロジベンゾ[b,e]チエピン)-11-イル]ブチルアミド
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: C28H30N3[N+]O2[O-]S
Molecular formula furigana: C28-H30-N4-O3-S
Molecular weight: 502.630
InChI: InChI=1S/C28H30N4O3S/c33-27(29-28-24-7-2-1-6-21(24)20-36-26-9-4-3-8-25(26)28)10-5-15-30-16-18-31(19-17-30)22-11-13-23(14-12-22)32(34)35/h1-4,6-9,11-14,28H,5,10,15-20H2,(H,29,33)
InChI key: CKCBNTPFARQMKX-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1ccc(cc1)N1CCN(CCCC(=O)NC2c3ccccc3CSc3ccccc23)CC1
Systematic name  (3):
  • 4-[4-(4-ニトロフェニル)-1-ピペラジニル]-N-[(6,11-ジヒドロジベンゾ[b,e]チエピン)-11-イル]ブチルアミド
  • 4-[4-(4-ニトロフェニル)ピペラジン-1-イル]-N-{9-チアトリシクロ[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}ブタンアミド
  • 4-[4-(4-nitrophenyl)piperazin-1-yl]-N-{9-thiatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}butanamide
Other name (1):
  • 4-[4-(4-Nitrophenyl)-1-piperazinyl]-N-[(6,11-dihydrodibenzo[b,e]thiepin)-11-yl]butyramide
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