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methyl 2-({[4-(5-chloro-3-methoxy-2-propoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]carbonyl}amino)benzoate
SpectraBase Compound ID 46JQbFum7OI
InChI InChI=1S/C24H26ClN3O5S/c1-5-10-33-21-16(11-14(25)12-18(21)31-3)20-19(13(2)26-24(34)28-20)22(29)27-17-9-7-6-8-15(17)23(30)32-4/h6-9,11-12,20H,5,10H2,1-4H3,(H,27,29)(H2,26,28,34)
InChIKey NNQLJMMBWJXYTF-UHFFFAOYSA-N
Mol Weight 504.0 g/mol
Molecular Formula C24H26ClN3O5S
Exact Mass 503.12817 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5k4LN2DnZtm
Name methyl 2-({[4-(5-chloro-3-methoxy-2-propoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]carbonyl}amino)benzoate
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/C24H26ClN3O5S/c1-5-10-33-21-16(11-14(25)12-18(21)31-3)20-19(13(2)26-24(34)28-20)22(29)27-17-9-7-6-8-15(17)23(30)32-4/h6-9,11-12,20H,5,10H2,1-4H3,(H,27,29)(H2,26,28,34)
InChIKey NNQLJMMBWJXYTF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31619
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: 1843101; SBI_ID: SBI-031623
Temperature 308 °C