Chem
J-GLOBAL ID：201507029299919817   Nikkaji number：J3.386.409D

1,1′-[(Hexafluorocyclopentene-1,2-diyl)bis[(2-methylthiophene-3,5-diyl)-p-phenylene]]bis[3-[3,4,5-tris(dodecyloxy)phenyl]urea]

1,1′-[(ヘキサフルオロシクロペンテン-1,2-ジイル)ビス[(2-メチルチオフェン-3,5-ジイル)-p-フェニレン]]ビス[3-[3,4,5-トリス(ドデシルオキシ)フェニル]尿素]
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： C113H174F6N4O8S2
Molecular formula furigana： C113-H174-F6-N4-O8-S2
Molecular weight： 1894.770
InChI： InChI=1S/C113H174F6N4O8S2/c1-9-15-21-27-33-39-45-51-57-63-77-126-99-83-95(84-100(127-78-64-58-52-46-40-34-28-22-16-10-2)107(99)130-81-67-61-55-49-43-37-31-25-19-13-5)122-109(124)120-93-73-69-91(70-74-93)103-87-97(89(7)132-103)105-106(112(116,117)113(118,119)111(105,114)115)98-88-104(133-90(98)8)92-71-75-94(76-72-92)121-110(125)123-96-85-101(128-79-65-59-53-47-41-35-29-23-17-11-3)108(131-82-68-62-56-50-44-38-32-26-20-14-6)102(86-96)129-80-66-60-54-48-42-36-30-24-18-12-4/h69-76,83-88H,9-68,77-82H2,1-8H3,(H2,120,122,124)(H2,121,123,125)
InChI key： NAUDJSFOTYDFAB-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1cc(NC(=O)Nc2ccc(cc2)c2cc(C3=C(c4cc(sc4C)c4ccc(NC(=O)Nc5cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c5)cc4)C(F)(F)C(F)(F)C3(F)F)c(C)s2)cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC
Systematic name  (5)：
  • 1,1′-[3,3,4,4,5,5-ヘキサフルオロシクロペンテン-1,2-ジイルビス[2-メチルチオフェン-3,5-ジイル(4,1-フェニレン)]]ビス[3-[3,4,5-トリス(ドデシルオキシ)フェニル]尿素]
  • 1,1′-[3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテン-1,2-ジイルビス[2-メチル-3,5-チオフェンジイル(1,4-フェニレン)]]ビス[3-[3,4,5-トリス(ドデシルオキシ)フェニル]尿素]
  • 1,1′-[(ヘキサフルオロシクロペンテン-1,2-ジイル)ビス[(2-メチルチオフェン-3,5-ジイル)-p-フェニレン]]ビス[3-[3,4,5-トリス(ドデシルオキシ)フェニル]尿素]
  • 1-{4-[4-(3,3,4,4,5,5-ヘキサフルオロ-2-{2-メチル-5-[4-({[3,4,5-トリス(ドデシルオキシ)フェニル]カルバモイル}アミノ)フェニル]チオフェン-3-イル}シクロペンタ-1-エン-1-イル)-5-メチルチオフェン-2-イル]フェニル}-3-[3,4,5-トリス(ドデシルオキシ)フェニル]尿素
  • 1-{4-[4-(3,3,4,4,5,5-hexafluoro-2-{2-methyl-5-[4-({[3,4,5-tris(dodecyloxy)phenyl]carbamoyl}amino)phenyl]thiophen-3-yl}cyclopent-1-en-1-yl)-5-methylthiophen-2-yl]phenyl}-3-[3,4,5-tris(dodecyloxy)phenyl]urea
Other name (3)：
  • 1,1′-[3,3,4,4,5,5-Hexafluorocyclopentene-1,2-diylbis[2-methylthiophene-3,5-diyl(4,1-phenylene)]]bis[3-[3,4,5-tris(dodecyloxy)phenyl]urea]
  • 1,1′-[3,3,4,4,5,5-Hexafluoro-1-cyclopentene-1,2-diylbis[2-methyl-3,5-thiophenediyl(1,4-phenylene)]]bis[3-[3,4,5-tris(dodecyloxy)phenyl]urea]
  • 1,1′-[(Hexafluorocyclopentene-1,2-diyl)bis[(2-methylthiophene-3,5-diyl)-p-phenylene]]bis[3-[3,4,5-tris(dodecyloxy)phenyl]urea]
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