1-Benzyl-5-phenyl-2-methylmercapto-1,3,4-triazolo[3,2-c]quinazolin-4-ium iodide

SpectraBase Compound ID	KivxbvEur7J
InChI	InChI=1S/C23H19N4S.HI/c1-28-23-25-27-21(18-12-6-3-7-13-18)24-20-15-9-8-14-19(20)22(27)26(23)16-17-10-4-2-5-11-17;/h2-15H,16H2,1H3;1H/q+1;/p-1
InChIKey	ODULVXBRCJPQCG-UHFFFAOYSA-M Google Search
Mol Weight	510.4 g/mol
Molecular Formula	C23H19IN4S
Exact Mass	510.037513 g/mol

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SpectraBase Spectrum ID	2UbiXbPBGC
Name	1-Benzyl-5-phenyl-2-methylmercapto-1,3,4-triazolo[3,2-c]quinazolin-4-ium iodide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H19IN4S
InChI	InChI=1S/C23H19N4S.HI/c1-28-23-25-27-21(18-12-6-3-7-13-18)24-20-15-9-8-14-19(20)22(27)26(23)16-17-10-4-2-5-11-17;/h2-15H,16H2,1H3;1H/q+1;/p-1
InChIKey	ODULVXBRCJPQCG-UHFFFAOYSA-M
Molecular Weight	510.397 g/mol
SMILES	[I-].c12[n+](nc([n]2Cc2ccccc2)SC)c(nc2ccccc12)-c1ccccc1
SPLASH	splash10-0006-5911000000-7b85f2f261049bd3cf89
Source of Spectrum	SO-0-883-5
Synonyms	1-Benzyl-2-(methylsulfanyl)-5-phenyl-1H-[1,2,4]triazolo[1,5-c]quinazolin-4-ium iodide
Wiley ID	1538238