2-{[4-(p-chlorophenyl)-5-(1-ethyl-3-methylpyrazol-5-yl)-4H-1,2,4-triazol-3-yl]thio}acetanilide

SpectraBase Compound ID	4r9mjvAcQF0
InChI	InChI=1S/C22H21ClN6OS/c1-3-28-19(13-15(2)27-28)21-25-26-22(29(21)18-11-9-16(23)10-12-18)31-14-20(30)24-17-7-5-4-6-8-17/h4-13H,3,14H2,1-2H3,(H,24,30)
InChIKey	MXQZCSUSNZXZIO-UHFFFAOYSA-N Google Search
Mol Weight	452.96 g/mol
Molecular Formula	C22H21ClN6OS
Exact Mass	452.118608 g/mol

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SpectraBase Spectrum ID	FziHKwE9Is4
Name	2-{[4-(p-CHLOROPHENYL)-5-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETANILIDE
Source of Sample	Maybridge Chemical Company Ltd., North Cornwall, England
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H21ClN6OS
InChI	InChI=1S/C22H21ClN6OS/c1-3-28-19(13-15(2)27-28)21-25-26-22(29(21)18-11-9-16(23)10-12-18)31-14-20(30)24-17-7-5-4-6-8-17/h4-13H,3,14H2,1-2H3,(H,24,30)
InChIKey	MXQZCSUSNZXZIO-UHFFFAOYSA-N
Melting Point	161-163C
Molecular Weight	452.97
Solvent	Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms	ACETANILIDE, 2-{[4-(p-CHLOROPHENYL)-5-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-4H-1,2,4-TRIAZOL-3-YL]THIO}-,