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ethyl 4-{3-(3,4-dimethoxybenzyl)-4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate
SpectraBase Compound ID 3vuBa2fcZvb
InChI InChI=1S/C30H31N3O7S/c1-5-40-29(36)20-7-11-22(12-8-20)33-28(35)24(17-27(34)31-21-9-13-23(37-2)14-10-21)32(30(33)41)18-19-6-15-25(38-3)26(16-19)39-4/h6-16,24H,5,17-18H2,1-4H3,(H,31,34)
InChIKey WPTPJVIQRZABEP-UHFFFAOYSA-N
Mol Weight 577.65 g/mol
Molecular Formula C30H31N3O7S
Exact Mass 577.188272 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2mB2g2zuOYn
Name ethyl 4-{3-(3,4-dimethoxybenzyl)-4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-2-thioxo-1-imidazolidinyl}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/C30H31N3O7S/c1-5-40-29(36)20-7-11-22(12-8-20)33-28(35)24(17-27(34)31-21-9-13-23(37-2)14-10-21)32(30(33)41)18-19-6-15-25(38-3)26(16-19)39-4/h6-16,24H,5,17-18H2,1-4H3,(H,31,34)
InChIKey WPTPJVIQRZABEP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2283
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: D02359; Labnumber: MPOL-10726; SBI_ID: SBI-002285
Temperature 318 °C