SpectraBase Spectrum ID |
FAfKcZi8AqX |
Name |
1-n-Propyl-5-phenyl-2-methylmercapto-1,3,4-triazolo[3,2-c]quinazolin-4-ium iodide |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H19IN4S |
InChI |
InChI=1S/C19H19N4S.HI/c1-3-13-22-18-15-11-7-8-12-16(15)20-17(14-9-5-4-6-10-14)23(18)21-19(22)24-2;/h4-12H,3,13H2,1-2H3;1H/q+1;/p-1 |
InChIKey |
YXAGFVXZEOAUJC-UHFFFAOYSA-M |
Molecular Weight |
462.353 g/mol |
SMILES |
[I-].c12[n+](nc([n]2CCC)SC)c(nc2ccccc12)-c1ccccc1 |
SPLASH |
splash10-002f-1950000000-dbe73ee91d08ebad0325 |
Source of Spectrum |
SO-0-883-5 |
Synonyms |
2-(methylsulfanyl)-5-phenyl-1-propyl-1H-[1,2,4]triazolo[1,5-c]quinazolin-4-ium iodide |
Wiley ID |
1538239 |