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3-(2-chloro-6-phenoxybenzyl)-2-methyl-1-(phenylsulfonyl)-2-thiopseudourea
SpectraBase Compound ID ENhDH024Cuk
InChI InChI=1S/C21H19ClN2O3S2/c1-28-21(24-29(25,26)17-11-6-3-7-12-17)23-15-18-19(22)13-8-14-20(18)27-16-9-4-2-5-10-16/h2-14H,15H2,1H3,(H,23,24)
InChIKey GSPKOMWCZAITIL-UHFFFAOYSA-N
Mol Weight 446.97 g/mol
Molecular Formula C21H19ClN2O3S2
Exact Mass 446.052563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5grWgQHgg5w
Name 3-(2-CHLORO-6-PHENOXYBENZYL)-2-METHYL-1-(PHENYLSULFONYL)-2-THIOPSEUDOUREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClN2O3S2
InChI InChI=1S/C21H19ClN2O3S2/c1-28-21(24-29(25,26)17-11-6-3-7-12-17)23-15-18-19(22)13-8-14-20(18)27-16-9-4-2-5-10-16/h2-14H,15H2,1H3,(H,23,24)
InChIKey GSPKOMWCZAITIL-UHFFFAOYSA-N
Melting Point 108-110C
Molecular Weight 446.98
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PSEUDOUREA, 3-(2-CHLORO-6-PHENOXYBENZYL)-2-METHYL-1-(PHENYLSULFONYL)-2-THIO-,