Chem
J-GLOBAL ID：201107057043226762   Nikkaji number：J2.913.459F

1-[(2S)-2,4β-Bis(benzoyloxymethyl)thietane-2β-yl]thymine

1-[(2S)-2,4β-ビス(ベンゾイルオキシメチル)チエタン-2β-イル]チミン
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： C24H22N2O6S
Molecular formula furigana： C24-H22-N2-O6-S
Molecular weight： 466.510
InChI： InChI=1S/C24H22N2O6S/c1-16-13-26(23(30)25-20(16)27)24(15-32-22(29)18-10-6-3-7-11-18)12-19(33-24)14-31-21(28)17-8-4-2-5-9-17/h2-11,13,19H,12,14-15H2,1H3,(H,25,27,30)/t19-,24-/m0/s1
InChI key： GZPUNHXZSGOYJY-CYFREDJKSA-N
SMILES： Cc1cn(c(=O)[nH]c1=O)[C@@]1(COC(=O)c2ccccc2)C[C@@H](COC(=O)c2ccccc2)S1
Systematic name  (3)：
  • 1-[(2S)-2,4β-ビス(ベンゾイルオキシメチル)チエタン-2β-イル]チミン
  • [(2S,4S)-4-[(ベンゾイルオキシ)メチル]-2-(5-メチル-2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)チエタン-2-イル]メチル ベンゾアート
  • [(2S,4S)-4-[(benzoyloxy)methyl]-2-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)thietan-2-yl]methyl benzoate
Other name (1)：
  • 1-[(2S)-2,4β-Bis(benzoyloxymethyl)thietane-2β-yl]thymine
Thsaurus map：
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