Chem
J-GLOBAL ID：200907016275492632   Nikkaji number：J1.293.769E

MRS-1754

MRS-1754
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： C26H26N6O4
Molecular formula furigana： C26-H26-N6-O4
Molecular weight： 486.532
InChI： InChI=1S/C26H26N6O4/c1-3-13-31-24-22(25(34)32(14-4-2)26(31)35)29-23(30-24)18-7-11-20(12-8-18)36-16-21(33)28-19-9-5-17(15-27)6-10-19/h5-12H,3-4,13-14,16H2,1-2H3,(H,28,33)(H,29,30)
InChI key： AJBBEYXFRYFVNM-UHFFFAOYSA-N
SMILES： CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1
Systematic name  (4)：
  • N-(4-シアノフェニル)-2-[4-(1,3-ジプロピル-2,6-ジオキソ-3,7-ジヒドロ-1H-プリン-8-イル)フェノキシ]アセトアミド
  • N-(4-シアノフェニル)-2-[4-(1,3-ジプロピル-2,6-ジオキソ-2,3,6,7-テトラヒドロ-1H-プリン-8-イル)フェノキシ]アセトアミド
  • N-(4-シアノフェニル)-2-[4-(2,6-ジオキソ-1,3-ジプロピル-2,3,6,7-テトラヒドロ-1H-プリン-8-イル)フェノキシ]アセトアミド
  • N-(4-cyanophenyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamide
Other name (3)：
  • N-(4-Cyanophenyl)-2-[4-(1,3-dipropyl-2,6-dioxo-3,7-dihydro-1H-purine-8-yl)phenoxy]acetamide
  • N-(4-Cyanophenyl)-2-[4-(1,3-dipropyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purine-8-yl)phenoxy]acetamide
  • MRS-1754
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