6,7-DIMETHOXY-3-METHYL-1-(4-METHYLPHENYL)-N-(4'-BENZYL-5'-METHYLTHIO-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE
Compound with spectra: 1 NMR
| SpectraBase Compound ID | JDD8GybnBC0 |
|---|---|
| InChI | InChI=1S/C29H29N4O2S.ClH/c1-19-11-13-22(14-12-19)27-24-17-26(35-4)25(34-3)16-23(24)15-20(2)33(27)28-30-31-29(36-5)32(28)18-21-9-7-6-8-10-21;/h6-17H,18H2,1-5H3;1H/q+1;/p-1 |
| InChIKey | OQNDDGHSSBPVNA-UHFFFAOYSA-M |
| Mol Weight | 533.09 g/mol |
| Molecular Formula | C29H29ClN4O2S |
| Exact Mass | 532.169975 g/mol |
| Parent InChIKey | IVZUHHONQUFHAS-UHFFFAOYSA-M |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
6,7-DIMETHOXY-3-METHYL-1-(4-METHYLPHENYL)-N-(2'-BENZYL-5'-METHYLTHIO-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE
#3A/7;6,7-DIMETHOXY-3-METHYL-1-(3,4-DICHOLROPHENYL)-2-[5-[3-[4-(3,4-DIMETHYLPHENYL)-PIPERAZIN-1-YL]-PROPYLTHIO]-1,2,4-TRIAZOL-3-YL]-ISOQUINOLINIUM-CHLORIDE
2-[4-[5-[1-(2-chlorophenyl)-6,7-dimethoxy-3-methylisoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]piperazin-1-yl]ethanol
1-(2-chlorophenyl)-6,7-dimethoxy-3-methyl-2-[5-(4-methylpiperazin-1-yl)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]isoquinolin-2-ium
1-(2-chlorophenyl)-2-[5-(isopropylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
ANTSHEQTZMZQKF-UHFFFAOYSA-N
1-(2-chlorophenyl)-6,7-dimethoxy-3-methyl-2-(5-piperidino-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl)isoquinolin-2-ium
[5-[1-(2-chlorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-diethyl-amine
diallyl-[5-[1-(2-chlorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine
[5-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-diethyl-amine
| Title | Journal or Book | Year |
|---|---|---|
| On triazoles XLIII. Synthesis of 1,2,4-triazolyl isoquinolinium zwitter ions | Journal of Heterocyclic Chemistry | 2001 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.