Chem
J-GLOBAL ID：200907078885706095   Nikkaji number：J2.751.526F

HC-030031

HC-030031
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： C18H21N5O3
Molecular formula furigana： C18-H21-N5-O3
Molecular weight： 355.398
InChI： InChI=1S/C18H21N5O3/c1-11(2)12-5-7-13(8-6-12)20-14(24)9-23-10-19-16-15(23)17(25)22(4)18(26)21(16)3/h5-8,10-11H,9H2,1-4H3,(H,20,24)
InChI key： HEQDZPHDVAOBLN-UHFFFAOYSA-N
SMILES： CC(C)c1ccc(NC(=O)Cn2cnc3n(C)c(=O)n(C)c(=O)c23)cc1
Systematic name  (3)：
  • 1,2,3,6-テトラヒドロ-1,3-ジメチル-N-(4-イソプロピルフェニル)-2,6-ジオキソ-7H-プリン-7-アセトアミド
  • 2-(1,3-ジメチル-2,6-ジオキソ-2,3,6,7-テトラヒドロ-1H-プリン-7-イル)-N-[4-(プロパン-2-イル)フェニル]アセトアミド
  • 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Other name (2)：
  • 1,2,3,6-Tetrahydro-1,3-dimethyl-N-(4-isopropylphenyl)-2,6-dioxo-7H-purine-7-acetamide
  • HC-030031
CAS registry number： 349085-38-7
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