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N-{2-[(4-chlorophenyl)sulfanyl]phenyl}-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID KgriHMN29ve
InChI InChI=1S/C20H14ClF2N5OS/c1-11-10-15(17(22)23)28-20(24-11)26-18(27-28)19(29)25-14-4-2-3-5-16(14)30-13-8-6-12(21)7-9-13/h2-10,17H,1H3,(H,25,29)
InChIKey ZTKXVTXTJAIIBD-UHFFFAOYSA-N
Mol Weight 445.88 g/mol
Molecular Formula C20H14ClF2N5OS
Exact Mass 445.057565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3I0IC3Xitzm
Name N-{2-[(4-chlorophenyl)sulfanyl]phenyl}-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/C20H14ClF2N5OS/c1-11-10-15(17(22)23)28-20(24-11)26-18(27-28)19(29)25-14-4-2-3-5-16(14)30-13-8-6-12(21)7-9-13/h2-10,17H,1H3,(H,25,29)
InChIKey ZTKXVTXTJAIIBD-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1442
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: 9311410; UBI_ID: UBI-001443
Temperature 313 °C