Chem
J-GLOBAL ID：201707018783857250   Nikkaji number：J3.645.913A

5-(1-Methylcyclopropane-1-yloxy)-3-[6-(2β,6β-dimethylmorpholine-4-yl)pyrimidine-4-yl]-1H-indazole

3-{6-[(2R,6S)-2,6-ジメチルモルホリン-4-イル]ピリミジン-4-イル}-5-(1-メチルシクロプロポキシ)-1H-インダゾール
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： C21H25N5O2
Molecular formula furigana： C21-H25-N5-O2
Molecular weight： 379.464
InChI： InChI=1S/C21H25N5O2/c1-13-10-26(11-14(2)27-13)19-9-18(22-12-23-19)20-16-8-15(28-21(3)6-7-21)4-5-17(16)24-25-20/h4-5,8-9,12-14H,6-7,10-11H2,1-3H3,(H,24,25)/t13-,14+
InChI key： ATUUNJCZCOMUKD-OKILXGFUSA-N
SMILES： C[C@H]1CN(C[C@@H](C)O1)c1cc(ncn1)c1n[nH]c2ccc(OC3(C)CC3)cc12
Systematic name  (3)：
  • 5-(1-メチルシクロプロパン-1-イルオキシ)-3-[6-(2β,6β-ジメチルモルホリン-4-イル)ピリミジン-4-イル]-1H-インダゾール
  • 3-{6-[(2R,6S)-2,6-ジメチルモルホリン-4-イル]ピリミジン-4-イル}-5-(1-メチルシクロプロポキシ)-1H-インダゾール
  • 3-{6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl}-5-(1-methylcyclopropoxy)-1H-indazole
Other name (1)：
  • 5-(1-Methylcyclopropane-1-yloxy)-3-[6-(2β,6β-dimethylmorpholine-4-yl)pyrimidine-4-yl]-1H-indazole
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