Chem
J-GLOBAL ID：200907086791917214   Nikkaji number：J2.202.669K

5,10,15,20-Tetrakis[4-[4-[4-(diphenylamino)phenyl]-2,1,3-benzothiadiazole-7-yl]phenyl]-21H,23H-porphyrin

5,10,15,20-テトラキス[4-[4-[4-(ジフェニルアミノ)フェニル]-2,1,3-ベンゾチアジアゾール-7-イル]フェニル]-21H,23H-ポルフィリン
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： C140H90N16S4
Molecular formula furigana： C140-H90-N16-S4
Molecular weight： 2124.610
InChI： InChI=1S/C140H90N16S4/c1-9-25-101(26-10-1)153(102-27-11-2-12-28-102)109-65-57-93(58-66-109)117-77-73-113(133-137(117)149-157-145-133)89-41-49-97(50-42-89)129-121-81-83-123(141-121)130(98-51-43-90(44-52-98)114-74-78-118(138-134(114)146-158-150-138)94-59-67-110(68-60-94)154(103-29-13-3-14-30-103)104-31-15-4-16-32-104)125-85-87-127(143-125)132(100-55-47-92(48-56-100)116-76-80-120(140-136(116)148-160-152-140)96-63-71-112(72-64-96)156(107-37-21-7-22-38-107)108-39-23-8-24-40-108)128-88-86-126(144-128)131(124-84-82-122(129)142-124)99-53-45-91(46-54-99)115-75-79-119(139-135(115)147-159-151-139)95-61-69-111(70-62-95)155(105-33-17-5-18-34-105)106-35-19-6-20-36-106/h1-88,141,144H/b129-121-,129-122-,130-123-,130-125-,131-124-,131-126-,132-127-,132-128-
InChI key： NTDNUPRENCWOKE-QMMUCHMZSA-N
SMILES： C1=CC2=N/C/1=C(/c1ccc(cc1)c1ccc(c3ccc(cc3)N(c3ccccc3)c3ccccc3)c3nsnc13)\c1ccc([nH]1)/C(=C\1/C=CC(=N1)/C(=c\1/cc/c(=C/2\c2ccc(cc2)c2ccc(c3ccc(cc3)N(c3ccccc3)c3ccccc3)c3nsnc23)/[nH]1)/c1ccc(cc1)c1ccc(c2ccc(cc2)N(c2ccccc2)c2ccccc2)c2nsnc12)/c1ccc(cc1)c1ccc(c2ccc(cc2)N(c2ccccc2)c2ccccc2)c2nsnc12
Systematic name  (4)：
  • 5,10,15,20-テトラキス[4-[7-[4-(ジフェニルアミノ)フェニル]-2,1,3-ベンゾチアジアゾール-4-イル]フェニル]-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス[4-[4-[4-(ジフェニルアミノ)フェニル]-2,1,3-ベンゾチアジアゾール-7-イル]フェニル]-21H,23H-ポルフィリン
  • N,N-ジフェニル-4-(7-{4-[7,12,17-トリス(4-{7-[4-(ジフェニルアミノ)フェニル]-2,1,3-ベンゾチアジアゾール-4-イル}フェニル)-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン-2-イル]フェニル}-2,1,3-ベンゾチアジアゾール-4-イル)アニリン
  • N,N-diphenyl-4-(7-{4-[7,12,17-tris(4-{7-[4-(diphenylamino)phenyl]-2,1,3-benzothiadiazol-4-yl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}-2,1,3-benzothiadiazol-4-yl)aniline
Other name (2)：
  • 5,10,15,20-Tetrakis[4-[7-[4-(diphenylamino)phenyl]-2,1,3-benzothiadiazole-4-yl]phenyl]-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis[4-[4-[4-(diphenylamino)phenyl]-2,1,3-benzothiadiazole-7-yl]phenyl]-21H,23H-porphyrin
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