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N'-(4-chlorophenyl)-N-[1-(3-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
SpectraBase Compound ID EUGSkgHYbe6
InChI InChI=1S/C25H26ClN5O2S/c1-15-6-5-7-20(12-15)31-23(32)13-22(24(31)33)30(14-21-16(2)28-29(4)17(21)3)25(34)27-19-10-8-18(26)9-11-19/h5-12,22H,13-14H2,1-4H3,(H,27,34)
InChIKey ZWHZNUCFRSMDQO-UHFFFAOYSA-N
Mol Weight 496.03 g/mol
Molecular Formula C25H26ClN5O2S
Exact Mass 495.149574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DLcubavCX18
Name N'-(4-chlorophenyl)-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/C25H26ClN5O2S/c1-15-6-5-7-20(12-15)31-23(32)13-22(24(31)33)30(14-21-16(2)28-29(4)17(21)3)25(34)27-19-10-8-18(26)9-11-19/h5-12,22H,13-14H2,1-4H3,(H,27,34)
InChIKey ZWHZNUCFRSMDQO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12796
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/9312350; UBI_ID: UBI-012799
Temperature 313 °C