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7-(difluoromethyl)-5-(4-methoxyphenyl)-N-{3-[(4-methylphenyl)sulfanyl]-5-nitrophenyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID FrbFpQw0NmQ
InChI InChI=1S/C28H21F2N5O4S/c1-16-3-9-21(10-4-16)40-22-12-18(11-19(13-22)35(37)38)32-28(36)23-15-31-34-25(26(29)30)14-24(33-27(23)34)17-5-7-20(39-2)8-6-17/h3-15,26H,1-2H3,(H,32,36)
InChIKey JZGHFSWSZPYJLA-UHFFFAOYSA-N
Mol Weight 561.56 g/mol
Molecular Formula C28H21F2N5O4S
Exact Mass 561.128232 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FuSAjxB3lAG
Name 7-(difluoromethyl)-5-(4-methoxyphenyl)-N-{3-[(4-methylphenyl)sulfanyl]-5-nitrophenyl}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/C28H21F2N5O4S/c1-16-3-9-21(10-4-16)40-22-12-18(11-19(13-22)35(37)38)32-28(36)23-15-31-34-25(26(29)30)14-24(33-27(23)34)17-5-7-20(39-2)8-6-17/h3-15,26H,1-2H3,(H,32,36)
InChIKey JZGHFSWSZPYJLA-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9909
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/9317245; Labnumber: IRA1308; UZI_ID: UZI-009911
Temperature 313 °C