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N-{2-[(4-chlorophenyl)sulfanyl]phenyl}-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 6LbM678VLI4
InChI InChI=1S/C27H19ClF2N4OS/c1-16-6-8-17(9-7-16)22-14-23(25(29)30)34-26(32-22)20(15-31-34)27(35)33-21-4-2-3-5-24(21)36-19-12-10-18(28)11-13-19/h2-15,25H,1H3,(H,33,35)
InChIKey HWXFVJQPZZSFNF-UHFFFAOYSA-N
Mol Weight 520.99 g/mol
Molecular Formula C27H19ClF2N4OS
Exact Mass 520.093616 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8bGno7akhLU
Name N-{2-[(4-chlorophenyl)sulfanyl]phenyl}-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-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/C27H19ClF2N4OS/c1-16-6-8-17(9-7-16)22-14-23(25(29)30)34-26(32-22)20(15-31-34)27(35)33-21-4-2-3-5-24(21)36-19-12-10-18(28)11-13-19/h2-15,25H,1H3,(H,33,35)
InChIKey HWXFVJQPZZSFNF-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3824
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: 9318369; UBI_ID: UBI-003825
Temperature 308 °C