4-(3,5-dimethyl-1-pyrazolyl)-2-(3-pyridinylmethylthio)-1H-imidazo[4,5-d]pyridazine

SpectraBase Compound ID	33SYGw4mepV
InChI	InChI=1S/C16H15N7S/c1-10-6-11(2)23(22-10)15-14-13(8-18-21-15)19-16(20-14)24-9-12-4-3-5-17-7-12/h3-8H,9H2,1-2H3,(H,19,20)
InChIKey	PXPQFIMVYHBURY-UHFFFAOYSA-N Google Search
Mol Weight	337.41 g/mol
Molecular Formula	C16H15N7S
Exact Mass	337.110965 g/mol

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SpectraBase Spectrum ID	6Gx1fIJHz8d
Name	4-(3,5-dimethyl-1-pyrazolyl)-2-(3-pyridinylmethylthio)-1H-imidazo[4,5-d]pyridazine
CAS Registry Number	85732-98-5
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H15N7S
InChI	InChI=1S/C16H15N7S/c1-10-6-11(2)23(22-10)15-14-13(8-18-21-15)19-16(20-14)24-9-12-4-3-5-17-7-12/h3-8H,9H2,1-2H3,(H,19,20)
InChIKey	PXPQFIMVYHBURY-UHFFFAOYSA-N
Molecular Weight	337.405 g/mol
SMILES	[nH]1c(nc2c1cnnc2-[n]1nc(C)cc1C)SCc1cnccc1
SPLASH	splash10-000i-0039000000-706e16177761c3124577
Source of Spectrum	Y-20-197-0
Synonyms	4-(3,5-dimethylpyrazol-1-yl)-2-(3-pyridylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine 4-(3,5-dimethylpyrazol-1-yl)-2-(3-pyridylmethylthio)-1H-imidazo[4,5-d]pyridazine 4-(3,5-dimethylpyrazol-1-yl)-2-(pyridin-3-ylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine
Wiley ID	1332971