Chem
J-GLOBAL ID:200907049456117065   Nikkaji number:J1.682.339B

2-(2-Furyl)-6-[3-[4-(ethoxycarbonyl)phenyl]propyl]-6H-1,3,3a,5,6,7-hexaaza-as-indacene-4-amine

2-(2-フリル)-6-[3-[4-(エトキシカルボニル)フェニル]プロピル]-6H-1,3,3a,5,6,7-ヘキサアザ-as-インダセン-4-アミン
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: C22H21N7O3
Molecular formula furigana: C22-H21-N7-O3
Molecular weight: 431.456
InChI: InChI=1S/C22H21N7O3/c1-2-31-21(30)15-9-7-14(8-10-15)5-3-11-28-19-16(13-24-28)20-25-18(17-6-4-12-32-17)27-29(20)22(23)26-19/h4,6-10,12-13H,2-3,5,11H2,1H3,(H2,23,26)
InChI key: ONKVOHAWCUQFLD-UHFFFAOYSA-N
SMILES: CCOC(=O)c1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)c2ccco2)cc1
Systematic name  (3):
  • 2-(2-フリル)-6-[3-[4-(エトキシカルボニル)フェニル]プロピル]-6H-1,3,3a,5,6,7-ヘキサアザ-as-インダセン-4-アミン
  • エチル 4-{3-[7-アミノ-4-(フラン-2-イル)-3,5,6,8,10,11-ヘキサアザトリシクロ[7.3.0.02,6]ドデカ-1(9),2,4,7,11-ペンタエン-10-イル]プロピル}ベンゾアート
  • ethyl 4-{3-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexaazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]propyl}benzoate
Other name (1):
  • 2-(2-Furyl)-6-[3-[4-(ethoxycarbonyl)phenyl]propyl]-6H-1,3,3a,5,6,7-hexaaza-as-indacene-4-amine
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