Chem
J-GLOBAL ID：200907003792118606   Nikkaji number：J2.295.914J

N,N-Bis(4-methoxyphenyl)-4-[2-[4,5-bis(octylthio)-1,3-dithiol-2-ylidene]-5H-1,3-dithiolo[4,5-c]pyrrole-5-yl]aniline

N,N-ビス(4-メトキシフェニル)-4-[2-[4,5-ビス(オクチルチオ)-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-5-イル]アニリン
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： C44H54N2O2S6
Molecular formula furigana： C44-H54-N2-O2-S6
Molecular weight： 835.290
InChI： InChI=1S/C44H54N2O2S6/c1-5-7-9-11-13-15-29-49-41-42(50-30-16-14-12-10-8-6-2)54-44(53-41)43-51-39-31-45(32-40(39)52-43)33-17-19-34(20-18-33)46(35-21-25-37(47-3)26-22-35)36-23-27-38(48-4)28-24-36/h17-28,31-32H,5-16,29-30H2,1-4H3
InChI key： UKUQSYMQBXTHDJ-UHFFFAOYSA-N
SMILES： CCCCCCCCSC1=C(SCCCCCCCC)SC(=c2sc3cn(cc3s2)c2ccc(cc2)N(c2ccc(OC)cc2)c2ccc(OC)cc2)S1
Systematic name  (3)：
  • N,N-ビス(4-メトキシフェニル)-4-[2-[4,5-ビス(オクチルチオ)-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-5-イル]アニリン
  • 4-{2-[4,5-ビス(オクチルスルファニル)-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-5-イル}-N,N-ビス(4-メトキシフェニル)アニリン
  • 4-{2-[4,5-bis(octylsulfanyl)-2H-1,3-dithiol-2-ylidene]-2H,5H-[1,3]dithiolo[4,5-c]pyrrol-5-yl}-N,N-bis(4-methoxyphenyl)aniline
Other name (1)：
  • N,N-Bis(4-methoxyphenyl)-4-[2-[4,5-bis(octylthio)-1,3-dithiol-2-ylidene]-5H-1,3-dithiolo[4,5-c]pyrrole-5-yl]aniline
Thsaurus map：
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