Chem
J-GLOBAL ID:200907057135607160
Nikkaji number:J1.783.358H
4,7-Bis(1-methylpyridinium-3-ylethynyl)-2,1,3-benzothiadiazole
4,7-ビス(1-メチルピリジニウム-3-イルエチニル)-2,1,3-ベンゾチアジアゾール
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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:
C22 H16 N2 [N+]2 S
Molecular formula furigana:
C22-H16-N4-S
Molecular weight:
368.460
InChI:
InChI=1S/C22H16N4S/c1-25-13-3-5-17(15-25)7-9-19-11-12-20(22-21(19)23-27-24-22)10-8-18-6-4-14-26(2)16-18/h3-6,11-16H,1-2H3/q+2
InChI key:
ZTGVSBBZOJQTAP-UHFFFAOYSA-N
SMILES:
C[n+]1cccc(c1)C#Cc1ccc(C#Cc2ccc[n+](C)c2)c2nsnc12
Systematic name (6):
3,3′-[(2,1,3-ベンゾチアジアゾール-4,7-ジイル)ビスエチニレン]ビス(1-メチルピリジニウム)
3,3′-[2,1,3-ベンゾチアジアゾール-4,7-ジイルビス(エチン-2,1-ジイル)]ビス(1-メチルピリジニウム)
4,7-ビス(1-メチルピリジニウム-3-イルエチニル)-2,1,3-ベンゾチアジアゾール
3,3′-[(2,1,3-ベンゾチアジアゾール-4,7-ジイル)ビス(エチン-1,2-ジイル)]ビス(1-メチルピリジニウム)
1-メチル-3-(2-{7-[2-(1-メチルピリジン-1-イウム-3-イル)エチニル]-2,1,3-ベンゾチアジアゾール-4-イル}エチニル)ピリジン-1-イウム
1-methyl-3-(2-{7-[2-(1-methylpyridin-1-ium-3-yl)ethynyl]-2,1,3-benzothiadiazol-4-yl}ethynyl)pyridin-1-ium
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Other name (4):
3,3′-[(2,1,3-Benzothiadiazole-4,7-diyl)bisethynylene]bis(1-methylpyridinium)
3,3′-[2,1,3-Benzothiadiazole-4,7-diylbis(ethyne-2,1-diyl)]bis(1-methylpyridinium)
4,7-Bis(1-methylpyridinium-3-ylethynyl)-2,1,3-benzothiadiazole
3,3′-[(2,1,3-Benzothiadiazole-4,7-diyl)bis(ethyne-1,2-diyl)]bis(1-methylpyridinium)
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