5-(5-Chloro-3-isoxazol-4-yl-1-phenyl-1H-pyrazol-4-yl)-4-phenyl-2,4-dihydro-[1,2,4]triazole-3-thione

SpectraBase Compound ID	IahfW5RnCQQ
InChI	InChI=1S/C20H13ClN6OS/c21-18-16(19-23-24-20(29)26(19)14-7-3-1-4-8-14)17(13-11-22-28-12-13)25-27(18)15-9-5-2-6-10-15/h1-12H,(H,24,29)
InChIKey	IEAHWYQQSYVJGZ-UHFFFAOYSA-N Google Search
Mol Weight	420.88 g/mol
Molecular Formula	C20H13ClN6OS
Exact Mass	420.056008 g/mol

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SpectraBase Spectrum ID	1pgwhVhECe
Name	5-(5-Chloro-3-isoxazol-4-yl-1-phenyl-1H-pyrazol-4-yl)-4-phenyl-2,4-dihydro-[1,2,4]triazole-3-thione
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H13ClN6OS
InChI	InChI=1S/C20H13ClN6OS/c21-18-16(19-23-24-20(29)26(19)14-7-3-1-4-8-14)17(13-11-22-28-12-13)25-27(18)15-9-5-2-6-10-15/h1-12H,(H,24,29)
InChIKey	IEAHWYQQSYVJGZ-UHFFFAOYSA-N
Molecular Weight	420.878 g/mol
SMILES	N1C(N(C(=N1)c1c([n](-c2ccccc2)nc1-c1conc1)Cl)c1ccccc1)=S
SPLASH	splash10-01c1-9216300000-3afcace7b2fd3b008e6d
Source of Spectrum	QC-23-46-14
Synonyms	4-(4,5-Dihydro-1-phenyl-5-thioxo-1,3,4-triazol-2-yl)-3-isoxazolyl-5-chloro-1-phenylpyrazole 5-[5-chloro-3-(4-isoxazolyl)-1-phenyl-1H-pyrazol-4-yl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Wiley ID	1583884