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

View entire compound with spectra: 1 NMR

DIETHYL-[1-[4-(4-CHLOROPHENYL)-THIAZOL-2-YL]-4-CYANO-3-(4-HYDROXYPHENYL)-1H-PYRAZOL-5-YLAMINO]-(2-CHLOROPHENYL)-METHYLPHOSPHONATE
SpectraBase Compound ID 8MXHVpPlQen
InChI InChI=1S/2C30H26Cl2N5O4PS/c2*1-3-40-42(39,41-4-2)29(21-7-13-23(32)14-8-21)35-28-25(17-33)27(20-9-15-24(38)16-10-20)36-37(28)30-34-26(18-43-30)19-5-11-22(31)12-6-19/h2*5-16,18,29,35,38H,3-4H2,1-2H3
InChIKey UUYISFBXGHERQJ-UHFFFAOYSA-N
Mol Weight 1309.02 g/mol
Molecular Formula C60H52Cl4N10O8P2S2
Exact Mass 1306.164036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L38CTQmccNn
Name DIETHYL-[1-[4-(4-CHLOROPHENYL)-THIAZOL-2-YL]-4-CYANO-3-(4-HYDROXYPHENYL)-1H-PYRAZOL-5-YLAMINO]-(2-CHLOROPHENYL)-METHYLPHOSPHONATE
Compound Number 4J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H52Cl4N10O8P2S2
InChI InChI=1S/2C30H26Cl2N5O4PS/c2*1-3-40-42(39,41-4-2)29(21-7-13-23(32)14-8-21)35-28-25(17-33)27(20-9-15-24(38)16-10-20)36-37(28)30-34-26(18-43-30)19-5-11-22(31)12-6-19/h2*5-16,18,29,35,38H,3-4H2,1-2H3
InChIKey UUYISFBXGHERQJ-UHFFFAOYSA-N
Literature Reference Author A.A.SEDIEK,M.S.MUDARRIS,A.A.SHADDY
Literature Reference Citation LIFE.SCI.J.,11,9(2014)
Molecular Weight 1309.015 g/mol
Solvent CDCl3
Source File Reference UWBT13490