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4-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoyl}amino)-N-cyclopentyl-1-ethyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID HoWSPxTb2e0
InChI InChI=1S/C22H25ClN6O2/c1-2-28-14-19(20(27-28)22(31)25-18-5-3-4-6-18)26-21(30)16-9-7-15(8-10-16)12-29-13-17(23)11-24-29/h7-11,13-14,18H,2-6,12H2,1H3,(H,25,31)(H,26,30)
InChIKey DVXOLXTXQSOMPC-UHFFFAOYSA-N
Mol Weight 440.94 g/mol
Molecular Formula C22H25ClN6O2
Exact Mass 440.172752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1NmB31PY0uu
Name 4-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoyl}amino)-N-cyclopentyl-1-ethyl-1H-pyrazole-3-carboxamide
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/C22H25ClN6O2/c1-2-28-14-19(20(27-28)22(31)25-18-5-3-4-6-18)26-21(30)16-9-7-15(8-10-16)12-29-13-17(23)11-24-29/h7-11,13-14,18H,2-6,12H2,1H3,(H,25,31)(H,26,30)
InChIKey DVXOLXTXQSOMPC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30113
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: 1670660; SBI_ID: SBI-030117
Temperature 308 °C