4-chloranyl-2-[(3-chlorophenyl)methylsulfanyl]-7-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine

SpectraBase Compound ID	H6zV6ddO14d
InChI	InChI=1S/C17H14Cl2N6S/c1-9-6-10(2)25(24-9)16-14-13(15(19)22-23-16)20-17(21-14)26-8-11-4-3-5-12(18)7-11/h3-7H,8H2,1-2H3,(H,20,21)
InChIKey	BXQYVTUJIDPVPF-UHFFFAOYSA-N Google Search
Mol Weight	405.31 g/mol
Molecular Formula	C17H14Cl2N6S
Exact Mass	404.037771 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	K9m7Mndi9Gz
Name	4-chloranyl-2-[(3-chlorophenyl)methylsulfanyl]-7-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine
CAS Registry Number	85732-83-8
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H14Cl2N6S
InChI	InChI=1S/C17H14Cl2N6S/c1-9-6-10(2)25(24-9)16-14-13(15(19)22-23-16)20-17(21-14)26-8-11-4-3-5-12(18)7-11/h3-7H,8H2,1-2H3,(H,20,21)
InChIKey	BXQYVTUJIDPVPF-UHFFFAOYSA-N
Molecular Weight	405.307 g/mol
SMILES	[nH]1c2c(nc1SCc1cc(Cl)ccc1)c(nnc2-[n]1nc(C)cc1C)Cl
SPLASH	splash10-0kdi-0600900000-4e4a1cb80919cbfc87ad
Source of Spectrum	Y-20-195-0
Synonyms	4-chloro-2-[(3-chlorobenzyl)thio]-7-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine 4-chloro-2-[(3-chlorophenyl)methylsulfanyl]-7-(3,5-dimethylpyrazol-1-yl)-1H-imidazo[4,5-d]pyridazine 4-chloro-2-[(3-chlorophenyl)methylthio]-7-(3,5-dimethyl-1-pyrazolyl)-1H-imidazo[4,5-d]pyridazine
Wiley ID	1371053