Chem
J-GLOBAL ID：200907064316598321   Nikkaji number：J2.574.253B

2-Phenyl-3H-1-thiacyclopenta[cd]azulene

2-フェニル-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： C17H12S
Molecular formula furigana： C17-H12-S
Molecular weight： 248.340
InChI： InChI=1S/C17H12S/c1-2-7-13(8-3-1)17-14-11-10-12-6-4-5-9-15(18-17)16(12)14/h1-10H,11H2
InChI key： QMQGQPIYXXIKKC-UHFFFAOYSA-N
SMILES： C1C=C2C=CC=Cc3sc(c1c23)c1ccccc1
Systematic name  (3)：
  • 2-フェニル-3H-1-チアシクロペンタ[cd]アズレン
  • 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
  • 3-phenyl-2-thiatricyclo[5.4.1.04,12]dodeca-1(12),3,6,8,10-pentaene
Other name (1)：
  • 2-Phenyl-3H-1-thiacyclopenta[cd]azulene
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