Chem
J-GLOBAL ID：200907002169575161   Nikkaji number：J1.124.227H

(3aR,3aβ,7aα)-1,3-Bis[(S)-α-methylbenzyl]-5β,6β-dimethyloctahydro-1H-benzimidazole

(3aR,3aβ,7aα)-1,3-ビス[(S)-α-メチルベンジル]-5β,6β-ジメチルオクタヒドロ-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： C25H34N2
Molecular formula furigana： C25-H34-N2
Molecular weight： 362.561
InChI： InChI=1S/C25H34N2/c1-18-15-24-25(16-19(18)2)27(21(4)23-13-9-6-10-14-23)17-26(24)20(3)22-11-7-5-8-12-22/h5-14,18-21,24-25H,15-17H2,1-4H3/t18-,19+,20-,21-,24+,25+/m0/s1
InChI key： FBVYPAXWAKITKL-VSWDCLHOSA-N
SMILES： C[C@H](N1CN([C@@H](C)c2ccccc2)[C@@H]2C[C@@H](C)[C@@H](C)C[C@@H]12)c1ccccc1
Systematic name  (3)：
  • (3aR,3aβ,7aα)-1,3-ビス[(S)-α-メチルベンジル]-5β,6β-ジメチルオクタヒドロ-1H-ベンゾイミダゾール
  • (3aR,5R,6S,7aR)-5,6-ジメチル-1,3-ビス[(1S)-1-フェニルエチル]-オクタヒドロ-1H-1,3-ベンゾジアゾール
  • (3aR,5R,6S,7aR)-5,6-dimethyl-1,3-bis[(1S)-1-phenylethyl]-octahydro-1H-1,3-benzodiazole
Other name (1)：
  • (3aR,3aβ,7aα)-1,3-Bis[(S)-α-methylbenzyl]-5β,6β-dimethyloctahydro-1H-benzimidazole
Thsaurus map：
Thesaurus Map

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