Chem
J-GLOBAL ID:200907047329045273   Nikkaji number:J1.328.067C

2-(5-Tosyl-5H-1,3-dithia-5-azapentalene-2-ylidene)-4,5-bis(methylthio)-1,3-dithiol

2-(5-トシル-5H-1,3-ジチア-5-アザペンタレン-2-イリデン)-4,5-ビス(メチルチオ)-1,3-ジチオール
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: C17H15NO2S7
Molecular formula furigana: C17-H15-N-O2-S7
Molecular weight: 489.730
InChI: InChI=1S/C17H15NO2S7/c1-10-4-6-11(7-5-10)27(19,20)18-8-12-13(9-18)24-16(23-12)17-25-14(21-2)15(22-3)26-17/h4-9H,1-3H3
InChI key: YCKPWBPSYAGJBV-UHFFFAOYSA-N
SMILES: CSC1=C(SC)SC(=c2sc3cn(cc3s2)S(=O)(=O)c2ccc(C)cc2)S1
Systematic name  (4):
  • 2-[4,5-ビス(メチルチオ)-1,3-ジチオール-2-イリデン]-5-トシル-5H-1,3-ジチオロ[4,5-c]ピロール
  • 2-(5-トシル-5H-1,3-ジチア-5-アザペンタレン-2-イリデン)-4,5-ビス(メチルチオ)-1,3-ジチオール
  • 2-[4,5-ビス(メチルスルファニル)-2H-1,3-ジチオール-2-イリデン]-5-(4-メチルベンゼンスルホニル)-2H,5H-[1,3]ジチオロ[4,5-c]ピロール
  • 2-[4,5-bis(methylsulfanyl)-2H-1,3-dithiol-2-ylidene]-5-(4-methylbenzenesulfonyl)-2H,5H-[1,3]dithiolo[4,5-c]pyrrole
Other name (2):
  • 2-[4,5-Bis(methylthio)-1,3-dithiol-2-ylidene]-5-tosyl-5H-1,3-dithiolo[4,5-c]pyrrole
  • 2-(5-Tosyl-5H-1,3-dithia-5-azapentalene-2-ylidene)-4,5-bis(methylthio)-1,3-dithiol
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