Chem
J-GLOBAL ID:200907004614534325   Nikkaji number:J1.673.184F

2-[4-[(E)-3-[1-(2-Pyrimidinyl)-5-methyl-1H-pyrazole-4-yl]-2-propenyl]piperazino]-4-chlorophenol

2-[4-[(E)-3-[1-(2-ピリミジニル)-5-メチル-1H-ピラゾール-4-イル]-2-プロペニル]ピペラジノ]-4-クロロフェノール
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: C21H23ClN6O
Molecular formula furigana: C21-H23-CL-N6-O
Molecular weight: 410.910
InChI: InChI=1S/C21H23ClN6O/c1-16-17(15-25-28(16)21-23-7-3-8-24-21)4-2-9-26-10-12-27(13-11-26)19-14-18(22)5-6-20(19)29/h2-8,14-15,29H,9-13H2,1H3/b4-2+
InChI key: JVORMXSSKRLFBE-DUXPYHPUSA-N
SMILES: Cc1c(/C=C/CN2CCN(CC2)c2cc(Cl)ccc2O)cnn1c1ncccn1
Systematic name  (3):
  • 2-[4-[(E)-3-[1-(2-ピリミジニル)-5-メチル-1H-ピラゾール-4-イル]-2-プロペニル]ピペラジノ]-4-クロロフェノール
  • 4-クロロ-2-{4-[(2E)-3-[5-メチル-1-(ピリミジン-2-イル)-1H-ピラゾール-4-イル]プロパ-2-エン-1-イル]ピペラジン-1-イル}フェノール
  • 4-chloro-2-{4-[(2E)-3-[5-methyl-1-(pyrimidin-2-yl)-1H-pyrazol-4-yl]prop-2-en-1-yl]piperazin-1-yl}phenol
Other name (1):
  • 2-[4-[(E)-3-[1-(2-Pyrimidinyl)-5-methyl-1H-pyrazole-4-yl]-2-propenyl]piperazino]-4-chlorophenol
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