2-[(3-chlorobenzyl)thio]-4-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine

SpectraBase Compound ID	IZSqXjHo35s
InChI	InChI=1S/C17H15ClN6S/c1-10-6-11(2)24(23-10)16-15-14(8-19-22-16)20-17(21-15)25-9-12-4-3-5-13(18)7-12/h3-8H,9H2,1-2H3,(H,20,21)
InChIKey	TVJAYTOJKUEBAW-UHFFFAOYSA-N Google Search
Mol Weight	370.86 g/mol
Molecular Formula	C17H15ClN6S
Exact Mass	370.076743 g/mol

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SpectraBase Spectrum ID	1FaGE5hmUoK
Name	2-[(3-chlorobenzyl)thio]-4-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine
CAS Registry Number	85732-92-9
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H15ClN6S
InChI	InChI=1S/C17H15ClN6S/c1-10-6-11(2)24(23-10)16-15-14(8-19-22-16)20-17(21-15)25-9-12-4-3-5-13(18)7-12/h3-8H,9H2,1-2H3,(H,20,21)
InChIKey	TVJAYTOJKUEBAW-UHFFFAOYSA-N
Molecular Weight	370.862 g/mol
SMILES	[nH]1c(nc2c1cnnc2-[n]1nc(C)cc1C)SCc1cc(Cl)ccc1
SPLASH	splash10-00b9-0908000000-9f218ff4f38f2e7ef8a5
Source of Spectrum	Y-20-196-0
Synonyms	2-[(3-chlorophenyl)methylsulfanyl]-4-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine 2-[(3-chlorophenyl)methylthio]-4-(3,5-dimethyl-1-pyrazolyl)-1H-imidazo[4,5-d]pyridazine
Wiley ID	1354057