Chem
J-GLOBAL ID：202007000151325090   Nikkaji number：J3.750.303G

BLU9931

N-[2-[6-(2,6-ジクロロ-3,5-ジメトキシフェニル)キナゾリン-2-イルアミノ]-3-メチルフェニル]アクリルアミド
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： C26H22Cl2N4O3
Molecular formula furigana： C26-H22-CL2-N4-O3
Molecular weight： 509.390
InChI： InChI=1S/C26H22Cl2N4O3/c1-5-21(33)30-18-8-6-7-14(2)25(18)32-26-29-13-16-11-15(9-10-17(16)31-26)22-23(27)19(34-3)12-20(35-4)24(22)28/h5-13H,1H2,2-4H3,(H,30,33)(H,29,31,32)
InChI key： TXEBNKKOLVBTFK-UHFFFAOYSA-N
SMILES： C=CC(=O)Nc1c(c(ccc1)C)Nc1nc2ccc(cc2cn1)c1c(c(cc(c1Cl)OC)OC)Cl
Systematic name  (3)：
  • N-[2-[6-(2,6-ジクロロ-3,5-ジメトキシフェニル)キナゾリン-2-イルアミノ]-3-メチルフェニル]アクリルアミド
  • N-(2-{[6-(2,6-ジクロロ-3,5-ジメトキシフェニル)キナゾリン-2-イル]アミノ}-3-メチルフェニル)プロパ-2-エンアミド
  • N-(2-{[6-(2,6-dichloro-3,5-dimethoxyphenyl)quinazolin-2-yl]amino}-3-methylphenyl)prop-2-enamide
Other name (2)：
  • BLU9931
  • BLU-9931
CAS registry number： 1538604-68-0
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