Chem
J-GLOBAL ID：200907033350864798   Nikkaji number：J1.743.844A

(4R)-1-Methyl-4β-(1-methyl-5-imidazolyl)-5α,6β-bis(tert-butyldiphenylsiloxymethyl)-4,5,6,7-tetrahydro-1H-benzimidazole

(4R)-1-メチル-4β-(1-メチル-5-イミダゾリル)-5α,6β-ビス(tert-ブチルジフェニルシロキシメチル)-4,5,6,7-テトラヒドロ-1H-ベンゾイミダゾール
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： C46H56N4O2Si2
Molecular formula furigana： C46-H56-N4-O2-SI2
Molecular weight： 753.150
InChI： InChI=1S/C46H56N4O2Si2/c1-45(2,3)53(36-21-13-9-14-22-36,37-23-15-10-16-24-37)51-31-35-29-41-44(48-34-50(41)8)43(42-30-47-33-49(42)7)40(35)32-52-54(46(4,5)6,38-25-17-11-18-26-38)39-27-19-12-20-28-39/h9-28,30,33-35,40,43H,29,31-32H2,1-8H3/t35-,40-,43-/m1/s1
InChI key： NSVARKSFXDVFTB-QGDMPUHRSA-N
SMILES： Cn1cnc2[C@H]([C@H](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)[C@@H](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)Cc12)c1cncn1C
Systematic name  (3)：
  • (4R)-1-メチル-4β-(1-メチル-5-イミダゾリル)-5α,6β-ビス(tert-ブチルジフェニルシロキシメチル)-4,5,6,7-テトラヒドロ-1H-ベンゾイミダゾール
  • (4R,5S,6S)-5,6-ビス({[(tert-ブチルジフェニルシリル)オキシ]メチル})-1-メチル-4-(1-メチル-1H-イミダゾール-5-イル)-4,5,6,7-テトラヒドロ-1H-1,3-ベンゾジアゾール
  • (4R,5S,6S)-5,6-bis({[(tert-butyldiphenylsilyl)oxy]methyl})-1-methyl-4-(1-methyl-1H-imidazol-5-yl)-4,5,6,7-tetrahydro-1H-1,3-benzodiazole
Other name (1)：
  • (4R)-1-Methyl-4β-(1-methyl-5-imidazolyl)-5α,6β-bis(tert-butyldiphenylsiloxymethyl)-4,5,6,7-tetrahydro-1H-benzimidazole
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