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2-[3-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-oxo-2-thioxo-4-imidazolidinyl]-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID E20OJCnNCaB
InChI InChI=1S/C21H21N3O5S/c1-23-20(26)16(10-19(25)22-14-4-6-15(27-2)7-5-14)24(21(23)30)11-13-3-8-17-18(9-13)29-12-28-17/h3-9,16H,10-12H2,1-2H3,(H,22,25)
InChIKey UCYGVGOOEWLNOX-UHFFFAOYSA-N
Mol Weight 427.48 g/mol
Molecular Formula C21H21N3O5S
Exact Mass 427.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5fr0UM7a3ij
Name 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-oxo-2-thioxo-4-imidazolidinyl]-N-(4-methoxyphenyl)acetamide
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/C21H21N3O5S/c1-23-20(26)16(10-19(25)22-14-4-6-15(27-2)7-5-14)24(21(23)30)11-13-3-8-17-18(9-13)29-12-28-17/h3-9,16H,10-12H2,1-2H3,(H,22,25)
InChIKey UCYGVGOOEWLNOX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2249
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: D02325; Labnumber: MPOL-10267; SBI_ID: SBI-002251
Temperature 318 °C