Chem
J-GLOBAL ID：200907080707404942   Nikkaji number：J1.036.806E

5-Methyl-3-benzoyl-2-[[(3S)-4α-(benzyloxy)-5β-[(tert-butyldiphenylsiloxy)methyl]tetrahydrothiophene-3β-yl]oxy]pyrimidine-4(3H)-one

5-メチル-3-ベンゾイル-2-[[(3S)-4α-(ベンジルオキシ)-5β-[(tert-ブチルジフェニルシロキシ)メチル]テトラヒドロチオフェン-3β-イル]オキシ]ピリミジン-4(3H)-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： C40H42N2O5SSi
Molecular formula furigana： C40-H42-N2-O5-S-SI
Molecular weight： 690.930
InChI： InChI=1S/C40H42N2O5SSi/c1-29-25-41-39(42(37(29)43)38(44)31-19-11-6-12-20-31)47-34-28-48-35(36(34)45-26-30-17-9-5-10-18-30)27-46-49(40(2,3)4,32-21-13-7-14-22-32)33-23-15-8-16-24-33/h5-25,34-36H,26-28H2,1-4H3/t34-,35-,36+/m1/s1
InChI key： VXYDZIKXBVCNOX-LBYVEUBFSA-N
SMILES： Cc1cnc(O[C@@H]2CS[C@H](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)[C@H]2OCc2ccccc2)n(C(=O)c2ccccc2)c1=O
Systematic name  (3)：
  • 5-メチル-3-ベンゾイル-2-[[(3S)-4α-(ベンジルオキシ)-5β-[(tert-ブチルジフェニルシロキシ)メチル]テトラヒドロチオフェン-3β-イル]オキシ]ピリミジン-4(3H)-オン
  • 3-ベンゾイル-2-{[(3S,4S,5R)-4-(ベンジルオキシ)-5-{[(tert-ブチルジフェニルシリル)オキシ]メチル}チオラン-3-イル]オキシ}-5-メチル-3,4-ジヒドロピリミジン-4-オン
  • 3-benzoyl-2-{[(3S,4S,5R)-4-(benzyloxy)-5-{[(tert-butyldiphenylsilyl)oxy]methyl}thiolan-3-yl]oxy}-5-methyl-3,4-dihydropyrimidin-4-one
Other name (1)：
  • 5-Methyl-3-benzoyl-2-[[(3S)-4α-(benzyloxy)-5β-[(tert-butyldiphenylsiloxy)methyl]tetrahydrothiophene-3β-yl]oxy]pyrimidine-4(3H)-one
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