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

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3-(p-chlorobenzylidene)-N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thiocarbazimidic acid, methyl ester
SpectraBase Compound ID BYQdQNyFUOE
InChI InChI=1S/C23H17ClF3N5O2S3/c1-35-22(29-28-14-15-4-6-16(24)7-5-15)31-37(33,34)18-10-8-17(9-11-18)32-19(20-3-2-12-36-20)13-21(30-32)23(25,26)27/h2-14H,1H3,(H,29,31)/b28-14+
InChIKey RDSFDYOHURXXCS-CCVNUDIWSA-N
Mol Weight 584.05 g/mol
Molecular Formula C23H17ClF3N5O2S3
Exact Mass 583.018501 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KOnYXFybK9t
Name 3-(p-chlorobenzylidene)-N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thiocarbazimidic acid, methyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17ClF3N5O2S3
InChI InChI=1S/C23H17ClF3N5O2S3/c1-35-22(29-28-14-15-4-6-16(24)7-5-15)31-37(33,34)18-10-8-17(9-11-18)32-19(20-3-2-12-36-20)13-21(30-32)23(25,26)27/h2-14H,1H3,(H,29,31)/b28-14+
InChIKey RDSFDYOHURXXCS-CCVNUDIWSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 55871M
Solvent CDCl3