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N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

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N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID FQkNGTqgfJO
InChI InChI=1S/C20H18ClF2N7O/c1-10-8-15(17(22)23)30-20(24-10)26-18(28-30)19(31)25-16-11(2)27-29(12(16)3)9-13-6-4-5-7-14(13)21/h4-8,17H,9H2,1-3H3,(H,25,31)
InChIKey QIDHFJLRRQWCEJ-UHFFFAOYSA-N
Mol Weight 445.86 g/mol
Molecular Formula C20H18ClF2N7O
Exact Mass 445.122942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LOv5VKZ4AWS
Name N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-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/C20H18ClF2N7O/c1-10-8-15(17(22)23)30-20(24-10)26-18(28-30)19(31)25-16-11(2)27-29(12(16)3)9-13-6-4-5-7-14(13)21/h4-8,17H,9H2,1-3H3,(H,25,31)
InChIKey QIDHFJLRRQWCEJ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1445
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: 9311859; UBI_ID: UBI-001446
Temperature 313 °C