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N-(4-methoxy-3-nitrobenzoyl)-N'-(2-methyl-3-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)thiourea
SpectraBase Compound ID 3cc00cv146f
InChI InChI=1S/C22H17N5O5S/c1-12-14(21-25-19-18(32-21)7-4-10-23-19)5-3-6-15(12)24-22(33)26-20(28)13-8-9-17(31-2)16(11-13)27(29)30/h3-11H,1-2H3,(H2,24,26,28,33)
InChIKey OZHPEIAENZLWCY-UHFFFAOYSA-N
Mol Weight 463.47 g/mol
Molecular Formula C22H17N5O5S
Exact Mass 463.09504 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JVwhJmjYC7U
Name N-(4-methoxy-3-nitrobenzoyl)-N'-(2-methyl-3-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)thiourea
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/C22H17N5O5S/c1-12-14(21-25-19-18(32-21)7-4-10-23-19)5-3-6-15(12)24-22(33)26-20(28)13-8-9-17(31-2)16(11-13)27(29)30/h3-11H,1-2H3,(H2,24,26,28,33)
InChIKey OZHPEIAENZLWCY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8516
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: E12707; Labnumber: SPMOS1-24498; SBI_ID: SBI-008519
Temperature 318 °C