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DIETHYL-[4-CYANO-3-(4-HYDROXYPHENYL)-1-(4-PHENYLTHIAZOL-2-YL)-1H-PYRAZOL-5-YLAMINO]-(4-METHOXYPHENYL)-METHYLPHOSPHONATE

View entire compound with spectra: 2 NMR

DIETHYL-[4-CYANO-3-(4-HYDROXYPHENYL)-1-(4-PHENYLTHIAZOL-2-YL)-1H-PYRAZOL-5-YLAMINO]-(4-METHOXYPHENYL)-METHYLPHOSPHONATE
SpectraBase Compound ID 8gMUlXJ64cc
InChI InChI=1S/2C31H30N5O5PS/c2*1-4-40-42(38,41-5-2)30(23-13-17-25(39-3)18-14-23)34-29-26(19-32)28(22-11-15-24(37)16-12-22)35-36(29)31-33-27(20-43-31)21-9-7-6-8-10-21/h2*6-18,20,30,34,37H,4-5H2,1-3H3
InChIKey XLBOHRIHHLLBKZ-UHFFFAOYSA-N
Mol Weight 1231.29 g/mol
Molecular Formula C62H60N10O10P2S2
Exact Mass 1230.341055 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BULI9mYhJil
Name DIETHYL-[4-CYANO-3-(4-HYDROXYPHENYL)-1-(4-PHENYLTHIAZOL-2-YL)-1H-PYRAZOL-5-YLAMINO]-(4-METHOXYPHENYL)-METHYLPHOSPHONATE
Compound Number 4F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H60N10O10P2S2
InChI InChI=1S/2C31H30N5O5PS/c2*1-4-40-42(38,41-5-2)30(23-13-17-25(39-3)18-14-23)34-29-26(19-32)28(22-11-15-24(37)16-12-22)35-36(29)31-33-27(20-43-31)21-9-7-6-8-10-21/h2*6-18,20,30,34,37H,4-5H2,1-3H3
InChIKey XLBOHRIHHLLBKZ-UHFFFAOYSA-N
Literature Reference Author A.A.SEDIEK,M.S.MUDARRIS,A.A.SHADDY
Literature Reference Citation LIFE.SCI.J.,11,9(2014)
Solvent CDCl3
Source File Reference UWBT13486