Chem
J-GLOBAL ID：201707008884146848   Nikkaji number：J3.577.467J

CRT-0066101

2-(4-{[(2R)-2-アミノブチル]アミノ}ピリミジン-2-イル)-4-(1-メチル-1H-ピラゾール-4-イル)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： C18H22N6O
Molecular formula furigana： C18-H22-N6-O
Molecular weight： 338.415
InChI： InChI=1S/C18H22N6O/c1-3-14(19)10-21-17-6-7-20-18(23-17)15-8-12(4-5-16(15)25)13-9-22-24(2)11-13/h4-9,11,14,25H,3,10,19H2,1-2H3,(H,20,21,23)/t14-/m1/s1
InChI key： SCJXQZZYGYLKJG-CQSZACIVSA-N
SMILES： CC[C@@H](N)CNc1ccnc(n1)c1cc(ccc1O)c1cnn(C)c1
Systematic name  (3)：
  • 4-[3-[4-[[(R)-2-アミノブチル]アミノ]ピリミジン-2-イル]-4-ヒドロキシフェニル]-1-メチル-1H-ピラゾール
  • 2-(4-{[(2R)-2-アミノブチル]アミノ}ピリミジン-2-イル)-4-(1-メチル-1H-ピラゾール-4-イル)フェノール
  • 2-(4-{[(2R)-2-aminobutyl]amino}pyrimidin-2-yl)-4-(1-methyl-1H-pyrazol-4-yl)phenol
Other name (2)：
  • 4-[3-[4-[[(R)-2-Aminobutyl]amino]pyrimidine-2-yl]-4-hydroxyphenyl]-1-methyl-1H-pyrazole
  • CRT-0066101
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