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ethyl 2-(4-{5-[(benzylamino)carbonyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl}-5-chloro-2-methoxyphenoxy)propanoate
SpectraBase Compound ID E4YOBf3UUVU
InChI InChI=1S/C25H28ClN3O5S/c1-5-33-24(31)15(3)34-20-12-18(26)17(11-19(20)32-4)22-21(14(2)28-25(35)29-22)23(30)27-13-16-9-7-6-8-10-16/h6-12,15,22H,5,13H2,1-4H3,(H,27,30)(H2,28,29,35)
InChIKey OIKXLYHYPUHWIQ-UHFFFAOYSA-N
Mol Weight 518.03 g/mol
Molecular Formula C25H28ClN3O5S
Exact Mass 517.14382 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CTCY0Cb2jnU
Name ethyl 2-(4-{5-[(benzylamino)carbonyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl}-5-chloro-2-methoxyphenoxy)propanoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H28ClN3O5S/c1-5-33-24(31)15(3)34-20-12-18(26)17(11-19(20)32-4)22-21(14(2)28-25(35)29-22)23(30)27-13-16-9-7-6-8-10-16/h6-12,15,22H,5,13H2,1-4H3,(H,27,30)(H2,28,29,35)
InChIKey OIKXLYHYPUHWIQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31540
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1842989; SBI_ID: SBI-031544
Temperature 308 °C