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DIETHYL-(2-CHLORO-6-FLUOROPHENYL)-[4-(N-THIAZOL-2-YL-SULFAMOYL)-PHENYLAMINO]-METHYL-PHOSPHONATE
SpectraBase Compound ID 3p4f0j8vKkw
InChI InChI=1S/C20H22ClFN3O5PS2/c1-3-29-31(26,30-4-2)19(18-16(21)6-5-7-17(18)22)24-14-8-10-15(11-9-14)33(27,28)25-20-23-12-13-32-20/h5-13,19,24H,3-4H2,1-2H3,(H,23,25)
InChIKey BOJDFWQEZVUBOX-UHFFFAOYSA-N
Mol Weight 533.96 g/mol
Molecular Formula C20H22ClFN3O5PS2
Exact Mass 533.041106 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUYVJdJzALi
Name DIETHYL-(2-CHLORO-6-FLUOROPHENYL)-[4-(N-THIAZOL-2-YL-SULFAMOYL)-PHENYLAMINO]-METHYL-PHOSPHONATE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22ClFN3O5PS2
InChI InChI=1S/C20H22ClFN3O5PS2/c1-3-29-31(26,30-4-2)19(18-16(21)6-5-7-17(18)22)24-14-8-10-15(11-9-14)33(27,28)25-20-23-12-13-32-20/h5-13,19,24H,3-4H2,1-2H3,(H,23,25)
InChIKey BOJDFWQEZVUBOX-UHFFFAOYSA-N
Literature Reference Author C.SAMPATH,K.V.VANI,Y.KOTAIAH,N.H.KRISHNA,C.N.RAJU,C.V.RAO
Literature Reference Citation J.CHEM.PHARM.RES.,4,2,1375(2012)
Solvent DMSO-D6
Source File Reference UWIR14030