Chem
J-GLOBAL ID:200907096416928476   Nikkaji number:J2.559.209C

α-Cyano-5-[4,5-[5,5′-bis[4-(diphenylamino)phenyl]biphenyl-2,2′-diyl]-1H-imidazole-2-yl]-2,2′-bithiophene-5′-acrylic acid

α-シアノ-5-[4,5-[5,5′-ビス[4-(ジフェニルアミノ)フェニル]ビフェニル-2,2′-ジイル]-1H-イミダゾール-2-イル]-2,2′-ビチオフェン-5′-アクリル酸
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: C63H41N5O2S2
Molecular formula furigana: C63-H41-N5-O2-S2
Molecular weight: 964.170
InChI: InChI=1S/C63H41N5O2S2/c64-40-45(63(69)70)37-52-31-34-57(71-52)58-35-36-59(72-58)62-65-60-53-32-25-43(41-21-27-50(28-22-41)67(46-13-5-1-6-14-46)47-15-7-2-8-16-47)38-55(53)56-39-44(26-33-54(56)61(60)66-62)42-23-29-51(30-24-42)68(48-17-9-3-10-18-48)49-19-11-4-12-20-49/h1-39H,(H,65,66)(H,69,70)
InChI key: ZNUVRSFDQZBOGB-UHFFFAOYSA-N
SMILES: OC(=O)C(=Cc1ccc(s1)c1ccc(s1)c1nc2c([nH]1)c1ccc(cc1c1cc(ccc21)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)C#N
Systematic name  (3):
  • α-シアノ-5-[4,5-[5,5′-ビス[4-(ジフェニルアミノ)フェニル]ビフェニル-2,2′-ジイル]-1H-イミダゾール-2-イル]-2,2′-ビチオフェン-5′-アクリル酸
  • 3-(5'-{6,9-ビス[4-(ジフェニルアミノ)フェニル]-1H-フェナントロ[9,10-d]イミダゾール-2-イル}-[2,2'-ビチオフェン]-5-イル)-2-シアノプロパ-2-エン酸
  • 3-(5'-{6,9-bis[4-(diphenylamino)phenyl]-1H-phenanthro[9,10-d]imidazol-2-yl}-[2,2'-bithiophen]-5-yl)-2-cyanoprop-2-enoic acid
Other name (1):
  • α-Cyano-5-[4,5-[5,5′-bis[4-(diphenylamino)phenyl]biphenyl-2,2′-diyl]-1H-imidazole-2-yl]-2,2′-bithiophene-5′-acrylic acid
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