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1-(4-chlorophenyl)-2-[5-(ethylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium

Compound with spectra: 1 NMR

1-(4-chlorophenyl)-2-[5-(ethylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
SpectraBase Compound ID JMxqs1md8NU
InChI InChI=1S/C22H21ClN4O2S/c1-5-30-22-24-21(25-26-22)27-13(2)10-15-11-18(28-3)19(29-4)12-17(15)20(27)14-6-8-16(23)9-7-14/h6-12H,5H2,1-4H3
InChIKey LFGVNZTVDYPWQA-UHFFFAOYSA-N
Mol Weight 440.95 g/mol
Molecular Formula C22H21ClN4O2S
Exact Mass 440.107375 g/mol

View Spectrum of 1-(4-chlorophenyl)-2-[5-(ethylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
BIS-[3-[6,7-DIMETHOXY-3-METHYL-1-(4-CHLOROPHENYL)-ISOQUINOLINIUM-2-YL]-1,2,4-TRIAZOLE-5-YLTHIO]-METHANE-DIBROMIDE
SEGZESOVFWLMHZ-UHFFFAOYSA-N
1-(4-chlorophenyl)-2-[5-(isopropylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
WZBMVJGVOXWJRP-UHFFFAOYSA-N
6,7-DIMETHOXY-3-METHYL-1-(4-METHYLPHENYL)-2-(5-ETHYLTHIO-1,2,4-TRIAZOL-3-YL)-ISOQUINOLINIUM-CHLORIDE
1-(4-fluorophenyl)-6,7-dimethoxy-3-methyl-2-(5-methylsulfanyl-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl)isoquinolin-2-ium
6,7-dimethoxy-3-methyl-1-(4-methylphenyl)-2-(5-methylsulfanyl-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl)isoquinolin-2-ium
3-METHYL-6,7-DIMETHOXY-1-(4-CHLOROPHENYL)-N-(5'-MERCAPTO-1'H-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE
3-METHYL-6,7-DIMETHOXY-1-(4-FLUOROPHENYL)-N-(5'-MERCAPTO-1'H-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE
3-METHYL-6,7-DIMETHOXY-1-(4-METHOXYPHENYL)-N-(5'-MERCAPTO-1'H-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE
Title Journal or Book Year
On triazoles XLIII. Synthesis of 1,2,4-triazolyl isoquinolinium zwitter ions Journal of Heterocyclic Chemistry 2001
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