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3-{[3-(4-chloro-2,5-dimethoxyanilino)-3-oxopropyl]sulfanyl}-N-(4-chloro-2,5-dimethoxyphenyl)propanamide
SpectraBase Compound ID 7qV7UZkhPBe
InChI InChI=1S/C22H26Cl2N2O6S/c1-29-17-11-15(19(31-3)9-13(17)23)25-21(27)5-7-33-8-6-22(28)26-16-12-18(30-2)14(24)10-20(16)32-4/h9-12H,5-8H2,1-4H3,(H,25,27)(H,26,28)
InChIKey LMKPMYNUTSQOIF-UHFFFAOYSA-N
Mol Weight 517.42 g/mol
Molecular Formula C22H26Cl2N2O6S
Exact Mass 516.088863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2yldjCx04kZ
Name 3-{[3-(4-chloro-2,5-dimethoxyanilino)-3-oxopropyl]sulfanyl}-N-(4-chloro-2,5-dimethoxyphenyl)propanamide
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/C22H26Cl2N2O6S/c1-29-17-11-15(19(31-3)9-13(17)23)25-21(27)5-7-33-8-6-22(28)26-16-12-18(30-2)14(24)10-20(16)32-4/h9-12H,5-8H2,1-4H3,(H,25,27)(H,26,28)
InChIKey LMKPMYNUTSQOIF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9567
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: UZI/9049986; UBI_ID: UBI-009570
Temperature 318 °C