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N-{3-[(4-chlorophenyl)sulfanyl]-5-nitrophenyl}-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

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N-{3-[(4-chlorophenyl)sulfanyl]-5-nitrophenyl}-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 6ijOAQkxAyJ
InChI InChI=1S/C27H18ClF2N5O4S/c1-39-19-6-2-15(3-7-19)23-13-24(25(29)30)34-26(33-23)22(14-31-34)27(36)32-17-10-18(35(37)38)12-21(11-17)40-20-8-4-16(28)5-9-20/h2-14,25H,1H3,(H,32,36)
InChIKey AQANFRIPVJEMFV-UHFFFAOYSA-N
Mol Weight 581.98 g/mol
Molecular Formula C27H18ClF2N5O4S
Exact Mass 581.073609 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AbuYOZzRkKV
Name N-{3-[(4-chlorophenyl)sulfanyl]-5-nitrophenyl}-7-(difluoromethyl)-5-(4-methoxyphenyl)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/C27H18ClF2N5O4S/c1-39-19-6-2-15(3-7-19)23-13-24(25(29)30)34-26(33-23)22(14-31-34)27(36)32-17-10-18(35(37)38)12-21(11-17)40-20-8-4-16(28)5-9-20/h2-14,25H,1H3,(H,32,36)
InChIKey AQANFRIPVJEMFV-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9897
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/9317519; Labnumber: IRA1279; UZI_ID: UZI-009899
Temperature 313 °C