Chem
J-GLOBAL ID：200907022176991775   Nikkaji number：J927.766H

1-[3-Ethyl-4-oxo-5-[3-methylbenzothiazol-2(3H)-ylidene]thiazolidin-2-ylidene]-1,2,3,4-tetrahydropyrido[2,1-b]benzothiazolium

1-[3-エチル-4-オキソ-5-[3-メチルベンゾチアゾール-2(3H)-イリデン]チアゾリジン-2-イリデン]-1,2,3,4-テトラヒドロピリド[2,1-b]ベンゾチアゾリウム
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： C24H22N2[N+]OS3
Molecular formula furigana： C24-H22-N3-O-S3
Molecular weight： 464.640
InChI： InChI=1S/C24H22N3OS3/c1-3-26-22(28)21(24-25(2)15-9-4-6-12-18(15)30-24)31-23(26)17-11-8-14-20-27(17)16-10-5-7-13-19(16)29-20/h4-7,9-10,12-13H,3,8,11,14H2,1-2H3/q+1
InChI key： CHZPLKSIOGLPBM-UHFFFAOYSA-N
SMILES： CCn1c(=O)c(=c2sc3ccccc3n2C)sc1=C1CCCc2sc3ccccc3[n+]12
Systematic name  (3)：
  • 1-[3-エチル-4-オキソ-5-[3-メチルベンゾチアゾール-2(3H)-イリデン]チアゾリジン-2-イリデン]-1,2,3,4-テトラヒドロピリド[2,1-b]ベンゾチアゾリウム
  • 13-[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]-8-チア-1λ5-アザトリシクロ[7.4.0.02,7]トリデカ-1(9),2,4,6-テトラエン-1-イリウム
  • 13-[3-ethyl-5-(3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-8-thia-1λ5-azatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-1-ylium
Other name (1)：
  • 1-[3-Ethyl-4-oxo-5-[3-methylbenzothiazol-2(3H)-ylidene]thiazolidin-2-ylidene]-1,2,3,4-tetrahydropyrido[2,1-b]benzothiazolium
Thsaurus map：
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