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N'-(3-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
SpectraBase Compound ID EReqmp5bcYA
InChI InChI=1S/C26H29N5O2S/c1-16-8-6-10-20(12-16)27-26(34)30(15-22-18(3)28-29(5)19(22)4)23-14-24(32)31(25(23)33)21-11-7-9-17(2)13-21/h6-13,23H,14-15H2,1-5H3,(H,27,34)
InChIKey RZLWEZYMBOXHFB-UHFFFAOYSA-N
Mol Weight 475.61 g/mol
Molecular Formula C26H29N5O2S
Exact Mass 475.204196 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DpjWN5BLNQt
Name N'-(3-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]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/C26H29N5O2S/c1-16-8-6-10-20(12-16)27-26(34)30(15-22-18(3)28-29(5)19(22)4)23-14-24(32)31(25(23)33)21-11-7-9-17(2)13-21/h6-13,23H,14-15H2,1-5H3,(H,27,34)
InChIKey RZLWEZYMBOXHFB-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1429
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: 9311992; UBI_ID: UBI-001430
Temperature 308 °C