Chem
J-GLOBAL ID：200907003959281970   Nikkaji number：J1.439.581D

3,4-[4,5-Bis(pentylthio)-1,3-dithiol-2-ylidenemethylenebisthio]-1H-pyrrole

3,4-[4,5-ビス(ペンチルチオ)-1,3-ジチオール-2-イリデンメチレンビスチオ]-1H-ピロール
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： C18H25NS6
Molecular formula furigana： C18-H25-N-S6
Molecular weight： 447.770
InChI： InChI=1S/C18H25NS6/c1-3-5-7-9-20-15-16(21-10-8-6-4-2)25-18(24-15)17-22-13-11-19-12-14(13)23-17/h11-12,19H,3-10H2,1-2H3
InChI key： NIFVAIUGJUEGKJ-UHFFFAOYSA-N
SMILES： CCCCCSC1=C(SCCCCC)SC(=c2sc3c[nH]cc3s2)S1
Systematic name  (4)：
  • 2-[4,5-ビス(ペンチルチオ)-1,3-ジチオール-2-イリデン]-5H-1,3-ジチオロ[4,5-c]ピロール
  • 3,4-[4,5-ビス(ペンチルチオ)-1,3-ジチオール-2-イリデンメチレンビスチオ]-1H-ピロール
  • 2-[4,5-ビス(ペンチルスルファニル)-2H-1,3-ジチオール-2-イリデン]-2H,5H-[1,3]ジチオロ[4,5-c]ピロール
  • 2-[4,5-bis(pentylsulfanyl)-2H-1,3-dithiol-2-ylidene]-2H,5H-[1,3]dithiolo[4,5-c]pyrrole
Other name (2)：
  • 2-[4,5-Bis(pentylthio)-1,3-dithiol-2-ylidene]-5H-1,3-dithiolo[4,5-c]pyrrole
  • 3,4-[4,5-Bis(pentylthio)-1,3-dithiol-2-ylidenemethylenebisthio]-1H-pyrrole
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