Chem
J-GLOBAL ID：201107038975511257   Nikkaji number：J2.968.992J

N-[2-[4-[4-[2-[(Tetrahydro-2H-pyran-2-yl)oxy]ethyl]-4′-[2-[4′-[2-[(tetrahydro-2H-pyran-2-yl)oxy]ethyl]-5′-(4-pyridinyl)-5-methyl-2,2′-bithiophene-4-yl]-3,3,4,4,5,5-hexafluoro-1-cyclopentenyl]-5′-methyl-2,2′-bithiophene-5-yl]phenoxy]ethyl]-N-methylcarbamic acid tert-butyl ester

tert-ブチル N-(2-{4-[4'-(3,3,4,4,5,5-ヘキサフルオロ-2-{5-メチル-4'-[2-(オキサン-2-イルオキシ)エチル]-5'-(ピリジン-4-イル)-[2,2'-ビチオフェン]-4-イル}シクロペンタ-1-エン-1-イル)-5'-メチル-4-[2-(オキサン-2-イルオキシ)エチル]-[2,2'-ビチオフェン]-5-イル]フェノキシ}エチル)-N-メチルカルバマート
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： C56H60F6N2O7S4
Molecular formula furigana： C56-H60-F6-N2-O7-S4
Molecular weight： 1115.330
InChI： InChI=1S/C56H60F6N2O7S4/c1-33-40(31-44(72-33)42-29-37(19-26-69-46-11-7-9-24-67-46)50(74-42)35-13-15-39(16-14-35)66-28-23-64(6)52(65)71-53(3,4)5)48-49(55(59,60)56(61,62)54(48,57)58)41-32-45(73-34(41)2)43-30-38(20-27-70-47-12-8-10-25-68-47)51(75-43)36-17-21-63-22-18-36/h13-18,21-22,29-32,46-47H,7-12,19-20,23-28H2,1-6H3
InChI key： JXEUQJAOFSIIFG-UHFFFAOYSA-N
SMILES： CN(CCOc1ccc(cc1)c1sc(cc1CCOC1CCCCO1)c1cc(C2=C(c3cc(sc3C)c3cc(CCOC4CCCCO4)c(s3)c3ccncc3)C(F)(F)C(F)(F)C2(F)F)c(C)s1)C(=O)OC(C)(C)C
Systematic name  (3)：
  • N-[2-[4-[4-[2-[(テトラヒドロ-2H-ピラン-2-イル)オキシ]エチル]-4′-[2-[4′-[2-[(テトラヒドロ-2H-ピラン-2-イル)オキシ]エチル]-5′-(4-ピリジニル)-5-メチル-2,2′-ビチオフェン-4-イル]-3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテニル]-5′-メチル-2,2′-ビチオフェン-5-イル]フェノキシ]エチル]-N-メチルカルバミド酸tert-ブチル
  • tert-ブチル N-(2-{4-[4'-(3,3,4,4,5,5-ヘキサフルオロ-2-{5-メチル-4'-[2-(オキサン-2-イルオキシ)エチル]-5'-(ピリジン-4-イル)-[2,2'-ビチオフェン]-4-イル}シクロペンタ-1-エン-1-イル)-5'-メチル-4-[2-(オキサン-2-イルオキシ)エチル]-[2,2'-ビチオフェン]-5-イル]フェノキシ}エチル)-N-メチルカルバマート
  • tert-butyl N-(2-{4-[4'-(3,3,4,4,5,5-hexafluoro-2-{5-methyl-4'-[2-(oxan-2-yloxy)ethyl]-5'-(pyridin-4-yl)-[2,2'-bithiophen]-4-yl}cyclopent-1-en-1-yl)-5'-methyl-4-[2-(oxan-2-yloxy)ethyl]-[2,2'-bithiophen]-5-yl]phenoxy}ethyl)-N-methylcarbamate
Other name (1)：
  • N-[2-[4-[4-[2-[(Tetrahydro-2H-pyran-2-yl)oxy]ethyl]-4′-[2-[4′-[2-[(tetrahydro-2H-pyran-2-yl)oxy]ethyl]-5′-(4-pyridinyl)-5-methyl-2,2′-bithiophene-4-yl]-3,3,4,4,5,5-hexafluoro-1-cyclopentenyl]-5′-methyl-2,2′-bithiophene-5-yl]phenoxy]ethyl]-N-methylcarbamic acid tert-butyl ester
Thsaurus map：
Thesaurus Map

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