Chem
J-GLOBAL ID：201407096736834666   Nikkaji number：J3.289.110A

2-Amino-8-[2-(4-methylphenyl)-2-oxoethylthio]-9H-purine-6(1H)-one

2-アミノ-8-[2-(4-メチルフェニル)-2-オキソエチルチオ]-9H-プリン-6(1H)-オン
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： C14H13N5O2S
Molecular formula furigana： C14-H13-N5-O2-S
Molecular weight： 315.350
InChI： InChI=1S/C14H13N5O2S/c1-7-2-4-8(5-3-7)9(20)6-22-14-16-10-11(18-14)17-13(15)19-12(10)21/h2-5H,6H2,1H3,(H4,15,16,17,18,19,21)
InChI key： HIGGTDYQNPXEFT-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)C(=O)CSc1nc2c(nc(N)[nH]c2=O)[nH]1
Systematic name  (3)：
  • 2-アミノ-8-[2-(4-メチルフェニル)-2-オキソエチルチオ]-9H-プリン-6(1H)-オン
  • 2-アミノ-8-{[2-(4-メチルフェニル)-2-オキソエチル]スルファニル}-6,9-ジヒドロ-1H-プリン-6-オン
  • 2-amino-8-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-6,9-dihydro-1H-purin-6-one
Other name (1)：
  • 2-Amino-8-[2-(4-methylphenyl)-2-oxoethylthio]-9H-purine-6(1H)-one
Thsaurus map：
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