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BIS-[3-[6,7-DIMETHOXY-3-METHYL-1-(4-CHLOROPHENYL)-ISOQUINOLINIUM-2-YL]-1,2,4-TRIAZOLE-5-YLTHIO]-METHANE-DIBROMIDE

Compound with spectra: 1 NMR

BIS-[3-[6,7-DIMETHOXY-3-METHYL-1-(4-CHLOROPHENYL)-ISOQUINOLINIUM-2-YL]-1,2,4-TRIAZOLE-5-YLTHIO]-METHANE-DIBROMIDE
SpectraBase Compound ID 9xCRtHMYBEA
InChI InChI=1S/C41H36Cl2N8O4S2.2BrH/c1-22-15-26-17-32(52-3)34(54-5)19-30(26)36(24-7-11-28(42)12-8-24)50(22)38-44-40(48-46-38)56-21-57-41-45-39(47-49-41)51-23(2)16-27-18-33(53-4)35(55-6)20-31(27)37(51)25-9-13-29(43)14-10-25;;/h7-20H,21H2,1-6H3,(H,44,46,48)(H,45,47,49);2*1H/q+2;;/p-2
InChIKey GQUZNJRZRDTGKE-UHFFFAOYSA-L
Mol Weight 999.6 g/mol
Molecular Formula C41H36Br2Cl2N8O4S2
Exact Mass 996.004475 g/mol
Parent InChIKey NATQDCLDOXMHFZ-UHFFFAOYSA-L

View Spectrum of BIS-[3-[6,7-DIMETHOXY-3-METHYL-1-(4-CHLOROPHENYL)-ISOQUINOLINIUM-2-YL]-1,2,4-TRIAZOLE-5-YLTHIO]-METHANE-DIBROMIDE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
1-(4-chlorophenyl)-2-[5-(ethylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
1-(4-chlorophenyl)-2-[5-(isopropylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
6,7-DIMETHOXY-3-METHYL-1-(4-METHYLPHENYL)-2-(5-ETHYLTHIO-1,2,4-TRIAZOL-3-YL)-ISOQUINOLINIUM-CHLORIDE
WZBMVJGVOXWJRP-UHFFFAOYSA-N
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
VMJCZWMOUNTLRK-UHFFFAOYSA-N
6,7-DIMETHOXY-3-METHYL-1-(4-METHYLPHENYL)-2-[5-[3-[4-(2-PYRIMIDINYL)-PIPERAZIN-1-YL]-PROPYLTHIO]-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 XLIX. Synthesis of 5,6-dihydrothiazolo[3,2-b]-[1,2,4]triazol-2-yl-, 6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-2-yl-, and 5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b] [1,3]thiazepin-2-yl-isoquinolinium salts Journal of Heterocyclic Chemistry 2003
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