Chem
J-GLOBAL ID：200907079115528004   Nikkaji number：J2.133.276C

2-[[(2Z)-5-(3-Methyl-2,3-dihydrobenzothiazole-2-ylidene)-3-ethyl-4-oxothiazolidine-2-ylidene]methyl]-1-methylnaphtho[1,2-d]thiazole-1-ium

2-[[(2Z)-5-(3-メチル-2,3-ジヒドロベンゾチアゾール-2-イリデン)-3-エチル-4-オキソチアゾリジン-2-イリデン]メチル]-1-メチルナフト[1,2-d]チアゾール-1-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： C26H22N2[N+]OS3
Molecular formula furigana： C26-H22-N3-O-S3
Molecular weight： 488.660
InChI： InChI=1S/C26H22N3OS3/c1-4-29-22(33-24(25(29)30)26-27(2)18-11-7-8-12-19(18)32-26)15-21-28(3)23-17-10-6-5-9-16(17)13-14-20(23)31-21/h5-15H,4H2,1-3H3/q+1
InChI key： KDLMMSCGTDFMNL-UHFFFAOYSA-N
SMILES： CCn1/c(=C/c2sc3ccc4ccccc4c3[n+]2C)/sc(=c2sc3ccccc3n2C)c1=O
Systematic name  (3)：
  • 2-[[(2Z)-5-(3-メチル-2,3-ジヒドロベンゾチアゾール-2-イリデン)-3-エチル-4-オキソチアゾリジン-2-イリデン]メチル]-1-メチルナフト[1,2-d]チアゾール-1-イウム
  • 2-{[(2Z)-3-エチル-5-(3-メチル-2,3-ジヒドロ-1,3-ベンゾチアゾール-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}-1-メチルナフト[1,2-d][1,3]チアゾール-1-イウム
  • 2-{[(2Z)-3-ethyl-5-(3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]methyl}-1-methylnaphtho[1,2-d][1,3]thiazol-1-ium
Other name (1)：
  • 2-[[(2Z)-5-(3-Methyl-2,3-dihydrobenzothiazole-2-ylidene)-3-ethyl-4-oxothiazolidine-2-ylidene]methyl]-1-methylnaphtho[1,2-d]thiazole-1-ium
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