Chem
J-GLOBAL ID：200907044695310851   Nikkaji number：J927.762E

2-[[3-Ethyl-4-oxo-5-[1-methylnaphtho[1,2-d]thiazol-2(1H)-ylidene]thiazolidin-2-ylidene]methyl]-3-ethylnaphtho[2,1-d]thiazol-3-ium

2-[[3-エチル-4-オキソ-5-[1-メチルナフト[1,2-d]チアゾール-2(1H)-イリデン]チアゾリジン-2-イリデン]メチル]-3-エチルナフト[2,1-d]チアゾール-3-イウム
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： C31H26N2[N+]OS3
Molecular formula furigana： C31-H26-N3-O-S3
Molecular weight： 552.750
InChI： InChI=1S/C31H26N3OS3/c1-4-33-23-16-14-20-11-7-9-13-22(20)28(23)37-25(33)18-26-34(5-2)30(35)29(38-26)31-32(3)27-21-12-8-6-10-19(21)15-17-24(27)36-31/h6-18H,4-5H2,1-3H3/q+1
InChI key： DFEUBRUFFWKQBD-UHFFFAOYSA-N
SMILES： CCn1c(=Cc2sc3c(ccc4ccccc34)[n+]2CC)sc(=c2sc3ccc4ccccc4c3n2C)c1=O
Systematic name  (3)：
  • 2-[[3-エチル-4-オキソ-5-[1-メチルナフト[1,2-d]チアゾール-2(1H)-イリデン]チアゾリジン-2-イリデン]メチル]-3-エチルナフト[2,1-d]チアゾール-3-イウム
  • 3-エチル-2-[(3-エチル-5-{1-メチル-1H,2H-ナフト[1,2-d][1,3]チアゾール-2-イリデン}-4-オキソ-1,3-チアゾリジン-2-イリデン)メチル]ナフト[2,1-d][1,3]チアゾール-3-イウム
  • 3-ethyl-2-[(3-ethyl-5-{1-methyl-1H,2H-naphtho[1,2-d][1,3]thiazol-2-ylidene}-4-oxo-1,3-thiazolidin-2-ylidene)methyl]naphtho[2,1-d][1,3]thiazol-3-ium
Other name (1)：
  • 2-[[3-Ethyl-4-oxo-5-[1-methylnaphtho[1,2-d]thiazol-2(1H)-ylidene]thiazolidin-2-ylidene]methyl]-3-ethylnaphtho[2,1-d]thiazol-3-ium
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