Chem
J-GLOBAL ID：200907043086929750   Nikkaji number：J2.397.335I

1,1′,10,10′-[2-[3-[3-[3-[3-[3-[3-[3-[3-(5-Ethyl-2-thienylethynyl)-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienyl]-1-methylpyrrolidine-3,3,4,4-tetrayl]-1′′,6′,7′,10′′-(1,1,2,2-ethenetetrayl)-6,6′′,7,7′′-(1,1,2,2-ethenetetrayl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexayl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene

1,1′,10,10′-[2-[3-[3-[3-[3-[3-[3-[3-[3-(5-エチル-2-チエニルエチニル)-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニル]-1-メチルピロリジン-3,3,4,4-テトライル]-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
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： C133H61NS9
Molecular formula furigana： C133-H61-N-S9
Molecular weight： 1961.500
InChI： InChI=1S/C133H61NS9/c1-11-55-29-30-64(135-55)28-20-47-38-56(12-2)136-65(47)31-21-48-39-57(13-3)137-66(48)32-22-49-40-58(14-4)138-67(49)33-23-50-41-59(15-5)139-68(50)34-24-51-42-60(16-6)140-69(51)35-25-52-43-61(17-7)141-70(52)36-26-53-44-62(18-8)142-71(53)37-27-54-45-63(19-9)143-130(54)131-133-128-122-116-106-94-86-78-74-72-73-76-80(78)88(94)98-92-84(76)85-77(73)81-79-75(72)83-82(74)90-96(86)104-110-100(90)101-91(83)97-87(79)95-89(81)99-93(85)103-102(92)114(108(98)116)124(128)125-115(103)109(99)117-107(95)113-105(97)111(101)119-118(110)126(120(122)112(104)106)132(133,46-134(131)10)127(119)121(113)123(117)129(125)133/h29-30,38-45,131H,11-19,46H2,1-10H3
InChI key： IKHPJYHCCFFLOU-UHFFFAOYSA-N
SMILES： CCc1ccc(s1)C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C#Cc1cc(CC)sc1C1N(C)CC23c4c5c6c2c2c7c8c9c%10c(c%11c4c4c%12c%11c%11c%10c%10c%13c9c9c7c7c2c2c6c6c%14c5c4c4c%14c5c%14c6c2c2c7c6c9c%13c7c9c%10c%11c%10c%12c4c4c%10c9c9c7c6c2c%14c9c54)C138
Systematic name  (3)：
  • 1,1′,10,10′-[2-[3-[3-[3-[3-[3-[3-[3-[3-(5-エチル-2-チエニルエチニル)-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニルエチニル]-5-エチル-2-チエニル]-1-メチルピロリジン-3,3,4,4-テトライル]-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
  • 20-[5-エチル-3-(2-{5-エチル-3-[2-(5-エチル-3-{2-[5-エチル-3-(2-{5-エチル-3-[2-(5-エチル-3-{2-[5-エチル-3-(2-{5-エチル-3-[2-(5-エチルチオフェン-2-イル)エチニル]チオフェン-2-イル}エチニル)チオフェン-2-イル]エチニル}チオフェン-2-イル)エチニル]チオフェン-2-イル}エチニル)チオフェン-2-イル]エチニル}チオフェン-2-イル)エチニル]チオフェン-2-イル}エチニル)チオフェン-2-イル]-21-メチル-21-アザドトリアコンタシクロ[8.7.46.02,6.03,27.04,34.05,61.07,63.08,17.09,14.011,57.012,55.013,49.015,48.016,19.018,26.019,23.023,47.024,45.025,29.028,33.030,44.031,42.032,36.035,60.037,41.038,59.039,56.040,53.043,52.046,51.050,54.058,62]トリヘキサコンタ-1(17),2(6),3(27),4(34),5(61),7,9(14),10,12(55),13(49),15,18(26),24,28,30(44),31(42),32,35,37,39(56),40,43(52),45,47,50,53,57,59,62-ノナコサエン
  • 20-[5-ethyl-3-(2-{5-ethyl-3-[2-(5-ethyl-3-{2-[5-ethyl-3-(2-{5-ethyl-3-[2-(5-ethyl-3-{2-[5-ethyl-3-(2-{5-ethyl-3-[2-(5-ethylthiophen-2-yl)ethynyl]thiophen-2-yl}ethynyl)thiophen-2-yl]ethynyl}thiophen-2-yl)ethynyl]thiophen-2-yl}ethynyl)thiophen-2-yl]ethynyl}thiophen-2-yl)ethynyl]thiophen-2-yl}ethynyl)thiophen-2-yl]-21-methyl-21-azadotriacontacyclo[8.7.46.02,6.03,27.04,34.05,61.07,63.08,17.09,14.011,57.012,55.013,49.015,48.016,19.018,26.019,23.023,47.024,45.025,29.028,33.030,44.031,42.032,36.035,60.037,41.038,59.039,56.040,53.043,52.046,51.050,54.058,62]trihexaconta-1(17),2(6),3(27),4(34),5(61),7,9(14),10,12(55),13(49),15,18(26),24,28,30(44),31(42),32,35,37,39(56),40,43(52),45,47,50,53,57,59,62-nonacosaene
Other name (1)：
  • 1,1′,10,10′-[2-[3-[3-[3-[3-[3-[3-[3-[3-(5-Ethyl-2-thienylethynyl)-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienylethynyl]-5-ethyl-2-thienyl]-1-methylpyrrolidine-3,3,4,4-tetrayl]-1′′,6′,7′,10′′-(1,1,2,2-ethenetetrayl)-6,6′′,7,7′′-(1,1,2,2-ethenetetrayl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexayl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene
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