N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thio-1-piperidinecarboximidic acid, methyl ester

SpectraBase Compound ID	EvDZ3AjLPy3
InChI	InChI=1S/C21H21F3N4O2S3/c1-31-20(27-11-3-2-4-12-27)26-33(29,30)16-9-7-15(8-10-16)28-17(18-6-5-13-32-18)14-19(25-28)21(22,23)24/h5-10,13-14H,2-4,11-12H2,1H3/b26-20-
InChIKey	RUFRNILTSVTBSX-QOMWVZHYSA-N Google Search
Mol Weight	514.6 g/mol
Molecular Formula	C21H21F3N4O2S3
Exact Mass	514.077874 g/mol

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SpectraBase Spectrum ID	AbV67aVsLw1
Name	N-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}THIO-1-PIPERIDINECARBOXIMIDIC ACID, METHYL ESTER
Source of Sample	MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H21F3N4O2S3
InChI	InChI=1S/C21H21F3N4O2S3/c1-31-20(27-11-3-2-4-12-27)26-33(29,30)16-9-7-15(8-10-16)28-17(18-6-5-13-32-18)14-19(25-28)21(22,23)24/h5-10,13-14H,2-4,11-12H2,1H3/b26-20-
InChIKey	RUFRNILTSVTBSX-QOMWVZHYSA-N
Melting Point	123-124C
Molecular Weight	514.61
Technique	KBr WAFER