| SpectraBase Spectrum ID |
KwHwjA3ez5p |
| Name |
3-METHYL-6,7-DIMETHOXY-1-(4-NITROPHENYL)-N-(5'-MERCAPTO-1'H-1,2,4-TRIAZOL-3'-YL)-ISOQUINOLINIUM-CHLORIDE |
| Compound Number |
6/7 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C20H18ClN5O4S |
| InChI |
InChI=1S/C20H17N5O4S.ClH/c1-11-8-13-9-16(28-2)17(29-3)10-15(13)18(24(11)19-21-20(30)23-22-19)12-4-6-14(7-5-12)25(26)27;/h4-10H,1-3H3,(H-,21,22,23,30);1H |
| InChIKey |
MDLZJKMWEXBHQS-UHFFFAOYSA-N |
| Literature Reference Author |
I.PRAUDA,J.REITER |
| Literature Reference Citation |
J.HETCYCL.CHEM.,40,1041(2003) |
| Literature Reference DOI |
10.1002/jhet.5570400612 |
| Molecular Weight |
459.907 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWMS22942 |
