Chem
J-GLOBAL ID：200907098533333460   Nikkaji number：J2.574.254K

2-Phenyl-4,7-ditert-butyl-3H-1-thiacyclopenta[cd]azulene

2-フェニル-4,7-ジtert-ブチル-3H-1-チアシクロペンタ[cd]アズレン
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： C25H28S
Molecular formula furigana： C25-H28-S
Molecular weight： 360.560
InChI： InChI=1S/C25H28S/c1-24(2,3)17-12-13-18-20(25(4,5)6)15-19-22(18)21(14-17)26-23(19)16-10-8-7-9-11-16/h7-14H,15H2,1-6H3
InChI key： YADHLFOMJKDUCO-UHFFFAOYSA-N
SMILES： CC(C)(C)C1=C2C=CC(=Cc3sc(c(C1)c23)c1ccccc1)C(C)(C)C
Systematic name  (3)：
  • 2-フェニル-4,7-ジtert-ブチル-3H-1-チアシクロペンタ[cd]アズレン
  • 6,10-ジ-tert-ブチル-3-フェニル-2-チアトリシクロ[5.4.1.04,12]ドデカ-1(12),3,6,8,10-ペンタエン
  • 6,10-di-tert-butyl-3-phenyl-2-thiatricyclo[5.4.1.04,12]dodeca-1(12),3,6,8,10-pentaene
Other name (1)：
  • 2-Phenyl-4,7-ditert-butyl-3H-1-thiacyclopenta[cd]azulene
Thsaurus map：
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