Chem
J-GLOBAL ID：200907002500990735   Nikkaji number：J2.719.805H

(3aR)-1-Tosyl-2-(2-pyridinyl)-4α,7α-isopropylidene-7-methyl-3aβ,4,5,6,7,7aβ-hexahydro-1H-benzoimidazole

(3aR)-1-トシル-2-(2-ピリジニル)-4α,7α-イソプロピリデン-7-メチル-3aβ,4,5,6,7,7aβ-ヘキサヒドロ-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： C23H27N3O2S
Molecular formula furigana： C23-H27-N3-O2-S
Molecular weight： 409.550
InChI： InChI=1S/C23H27N3O2S/c1-15-8-10-16(11-9-15)29(27,28)26-20-19(17-12-13-23(20,4)22(17,2)3)25-21(26)18-7-5-6-14-24-18/h5-11,14,17,19-20H,12-13H2,1-4H3/t17-,19-,20-,23+/m1/s1
InChI key： YNPORUZSPZTREE-CFKGEZKQSA-N
SMILES： Cc1ccc(cc1)S(=O)(=O)N1[C@@H]2[C@H](N=C1c1ccccn1)[C@H]1CC[C@]2(C)C1(C)C
Systematic name  (3)：
  • (3aR)-1-トシル-2-(2-ピリジニル)-4α,7α-イソプロピリデン-7-メチル-3aβ,4,5,6,7,7aβ-ヘキサヒドロ-1H-ベンゾイミダゾール
  • (1S,2R,6S,7R)-7,10,10-トリメチル-5-(4-メチルベンゼンスルホニル)-4-(ピリジン-2-イル)-3,5-ジアザトリシクロ[5.2.1.02,6]デカ-3-エン
  • (1S,2R,6S,7R)-7,10,10-trimethyl-5-(4-methylbenzenesulfonyl)-4-(pyridin-2-yl)-3,5-diazatricyclo[5.2.1.02,6]dec-3-ene
Other name (1)：
  • (3aR)-1-Tosyl-2-(2-pyridinyl)-4α,7α-isopropylidene-7-methyl-3aβ,4,5,6,7,7aβ-hexahydro-1H-benzoimidazole
Thsaurus map：
Thesaurus Map

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