1-(4-Chlorophenyl)-5-phenyl-2-mercapto-1,3,4-triazolo[3,2-c]quinazolin-4-ium

SpectraBase Compound ID	3N2a3tLg7V0
InChI	InChI=1S/C21H13ClN4S/c22-15-10-12-16(13-11-15)25-20-17-8-4-5-9-18(17)23-19(26(20)24-21(25)27)14-6-2-1-3-7-14/h1-13H
InChIKey	BKZSEJVKMMZFCZ-UHFFFAOYSA-N Google Search
Mol Weight	388.88 g/mol
Molecular Formula	C21H13ClN4S
Exact Mass	388.054945 g/mol

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SpectraBase Spectrum ID	G35bX1RxCMY
Name	1-(4-Chlorophenyl)-5-phenyl-2-mercapto-1,3,4-triazolo[3,2-c]quinazolin-4-ium
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H13ClN4S
InChI	InChI=1S/C21H13ClN4S/c22-15-10-12-16(13-11-15)25-20-17-8-4-5-9-18(17)23-19(26(20)24-21(25)27)14-6-2-1-3-7-14/h1-13H
InChIKey	BKZSEJVKMMZFCZ-UHFFFAOYSA-N
Molecular Weight	388.876 g/mol
SMILES	c12[n+](nc([n]2-c2ccc(cc2)Cl)[S-])c(nc2ccccc12)-c1ccccc1
SPLASH	splash10-0a4i-2289000000-3be15892a0ffcfceef9a
Source of Spectrum	SO-0-882-4
Synonyms	1-(4-Chlorophenyl)-5-phenyl-1H-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-2-thiolate 1-(4-Chlorophenyl)-5-phenyl-1H-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-2-ylsulfide
Wiley ID	1538247