Chem
J-GLOBAL ID：201107071544109890   Nikkaji number：J2.913.461H

1-[(2R)-3α,5α-Bis(benzoyloxymethyl)tetrahydrothiophene-2β-yl]thymine

1-[(2R)-3α,5α-ビス(ベンゾイルオキシメチル)テトラヒドロチオフェン-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： C25H24N2O6S
Molecular formula furigana： C25-H24-N2-O6-S
Molecular weight： 480.540
InChI： InChI=1S/C25H24N2O6S/c1-16-13-27(25(31)26-21(16)28)22-19(14-32-23(29)17-8-4-2-5-9-17)12-20(34-22)15-33-24(30)18-10-6-3-7-11-18/h2-11,13,19-20,22H,12,14-15H2,1H3,(H,26,28,31)/t19-,20+,22+/m0/s1
InChI key： UYALDUMIBOPPGF-TUNNFDKTSA-N
SMILES： Cc1cn([C@@H]2S[C@@H](COC(=O)c3ccccc3)C[C@H]2COC(=O)c2ccccc2)c(=O)[nH]c1=O
Systematic name  (3)：
  • 1-[(2R)-3α,5α-ビス(ベンゾイルオキシメチル)テトラヒドロチオフェン-2β-イル]チミン
  • [(2R,4S,5R)-4-[(ベンゾイルオキシ)メチル]-5-(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)チオラン-2-イル]メチル ベンゾアート
  • [(2R,4S,5R)-4-[(benzoyloxy)methyl]-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)thiolan-2-yl]methyl benzoate
Other name (1)：
  • 1-[(2R)-3α,5α-Bis(benzoyloxymethyl)tetrahydrothiophene-2β-yl]thymine
Thsaurus map：
Thesaurus Map

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