Chem
J-GLOBAL ID：200907098765870640   Nikkaji number：J1.673.174I

(E)-1-[1-(2-Pyrimidinyl)-5-methyl-1H-pyrazole-4-yl]-3-[4-(2,6-difluorophenyl)piperazino]-1-propene

(E)-1-[1-(2-ピリミジニル)-5-メチル-1H-ピラゾール-4-イル]-3-[4-(2,6-ジフルオロフェニル)ピペラジノ]-1-プロペン
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： C21H22F2N6
Molecular formula furigana： C21-H22-F2-N6
Molecular weight： 396.446
InChI： InChI=1S/C21H22F2N6/c1-16-17(15-26-29(16)21-24-8-4-9-25-21)5-3-10-27-11-13-28(14-12-27)20-18(22)6-2-7-19(20)23/h2-9,15H,10-14H2,1H3/b5-3+
InChI key： SMLWPZLEEHOPOQ-HWKANZROSA-N
SMILES： Cc1c(/C=C/CN2CCN(CC2)c2c(F)cccc2F)cnn1c1ncccn1
Systematic name  (3)：
  • (E)-1-[1-(2-ピリミジニル)-5-メチル-1H-ピラゾール-4-イル]-3-[4-(2,6-ジフルオロフェニル)ピペラジノ]-1-プロペン
  • 2-{4-[(1E)-3-[4-(2,6-ジフルオロフェニル)ピペラジン-1-イル]プロパ-1-エン-1-イル]-5-メチル-1H-ピラゾール-1-イル}ピリミジン
  • 2-{4-[(1E)-3-[4-(2,6-difluorophenyl)piperazin-1-yl]prop-1-en-1-yl]-5-methyl-1H-pyrazol-1-yl}pyrimidine
Other name (1)：
  • (E)-1-[1-(2-Pyrimidinyl)-5-methyl-1H-pyrazole-4-yl]-3-[4-(2,6-difluorophenyl)piperazino]-1-propene
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