Chem
J-GLOBAL ID：200907050366965774   Nikkaji number：J1.510.091E

4-[α-(Dimethylamino)benzylideneamino]-5,6-dihydro[1]benzoxepino[5,4-d]pyrimidine

4-[α-(ジメチルアミノ)ベンジリデンアミノ]-5,6-ジヒドロ[1]ベンゾオキセピノ[5,4-d]ピリミジン
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： C21H20N4O
Molecular formula furigana： C21-H20-N4-O
Molecular weight： 344.418
InChI： InChI=1S/C21H20N4O/c1-25(2)21(15-8-4-3-5-9-15)24-20-17-12-13-26-18-11-7-6-10-16(18)19(17)22-14-23-20/h3-11,14H,12-13H2,1-2H3
InChI key： RRZXBQQHZQYFCM-UHFFFAOYSA-N
SMILES： CN(C)C(=Nc1ncnc2c1CCOc1ccccc21)c1ccccc1
Systematic name  (3)：
  • 4-[α-(ジメチルアミノ)ベンジリデンアミノ]-5,6-ジヒドロ[1]ベンゾオキセピノ[5,4-d]ピリミジン
  • N,N-ジメチル-N'-{10-オキサ-3,5-ジアザトリシクロ[9.4.0.02,7]ペンタデカ-1(15),2(7),3,5,11,13-ヘキサエン-6-イル}ベンゼンカルボキシミドアミド
  • N,N-dimethyl-N'-{10-oxa-3,5-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,11,13-hexaen-6-yl}benzenecarboximidamide
Other name (1)：
  • 4-[α-(Dimethylamino)benzylideneamino]-5,6-dihydro[1]benzoxepino[5,4-d]pyrimidine
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