Chem
J-GLOBAL ID：200907073421382813   Nikkaji number：J944.927B

NNC-26-9100

1-[3-(5-イミダゾリジニル)プロピル]-3-[3-[(5-ブロモ-2-ピリジニル)(3,4-ジクロロベンジル)アミノ]プロピル]チオ尿素
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： C22H29BrCl2N6S
Molecular formula furigana： C22-H29-BR-CL2-N6-S
Molecular weight： 560.380
InChI： InChI=1S/C22H29BrCl2N6S/c23-17-5-7-21(29-12-17)31(14-16-4-6-19(24)20(25)11-16)10-2-9-28-22(32)27-8-1-3-18-13-26-15-30-18/h4-7,11-12,18,26,30H,1-3,8-10,13-15H2,(H2,27,28,32)
InChI key： BLLHGNRFSANIDV-UHFFFAOYSA-N
SMILES： Clc1ccc(CN(CCCNC(=S)NCCCC2CNCN2)c2ccc(Br)cn2)cc1Cl
Systematic name  (3)：
  • 1-[3-(5-イミダゾリジニル)プロピル]-3-[3-[(5-ブロモ-2-ピリジニル)(3,4-ジクロロベンジル)アミノ]プロピル]チオ尿素
  • 1-{3-[(5-ブロモピリジン-2-イル)[(3,4-ジクロロフェニル)メチル]アミノ]プロピル}-3-[3-(イミダゾリジン-4-イル)プロピル]チオ尿素
  • 1-{3-[(5-bromopyridin-2-yl)[(3,4-dichlorophenyl)methyl]amino]propyl}-3-[3-(imidazolidin-4-yl)propyl]thiourea
Other name (2)：
  • NNC-26-9100
  • 1-[3-(5-Imidazolidinyl)propyl]-3-[3-[(5-bromo-2-pyridinyl)(3,4-dichlorobenzyl)amino]propyl]thiourea
Thsaurus map：
Thesaurus Map

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