Chem
J-GLOBAL ID：200907070333460627   Nikkaji number：J1.150.449C

2-[[3-[2-[1-(Difluoroboryl)-2,4-dimethyl-1H-pyrrole-5-ylmethyl]-2H-pyrrole-5-yl]-1-oxopropyl]amino]acetaldehyde

3-(2-{[1-(ジフルオロボラニル)-3,5-ジメチル-1H-ピロール-2-イル]メチル}-2H-ピロール-5-イル)-N-(2-オキソエチル)プロパンアミド
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： C16H20BF2N3O2
Molecular formula furigana： C16-H20-B-F2-N3-O2
Molecular weight： 335.160
InChI： InChI=1S/C16H20BF2N3O2/c1-11-9-12(2)22(17(18)19)15(11)10-14-4-3-13(21-14)5-6-16(24)20-7-8-23/h3-4,8-9,14H,5-7,10H2,1-2H3,(H,20,24)
InChI key： GLJAUGJVSQBLBI-UHFFFAOYSA-N
SMILES： Cc1cc(C)n(B(F)F)c1CC1C=CC(=N1)CCC(=O)NCC=O
Systematic name  (3)：
  • 2-[[3-[2-[1-(ジフルオロボリル)-2,4-ジメチル-1H-ピロール-5-イルメチル]-2H-ピロール-5-イル]-1-オキソプロピル]アミノ]アセトアルデヒド
  • 3-(2-{[1-(ジフルオロボラニル)-3,5-ジメチル-1H-ピロール-2-イル]メチル}-2H-ピロール-5-イル)-N-(2-オキソエチル)プロパンアミド
  • 3-(2-{[1-(difluoroboranyl)-3,5-dimethyl-1H-pyrrol-2-yl]methyl}-2H-pyrrol-5-yl)-N-(2-oxoethyl)propanamide
Other name (1)：
  • 2-[[3-[2-[1-(Difluoroboryl)-2,4-dimethyl-1H-pyrrole-5-ylmethyl]-2H-pyrrole-5-yl]-1-oxopropyl]amino]acetaldehyde
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