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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID KCYaXSF0bGe
InChI InChI=1S/C24H18F3N5OS/c25-24(26,27)20-11-17(14-7-3-1-4-8-14)29-21-12-18(31-32(20)21)22(33)30-23-16(13-28)15-9-5-2-6-10-19(15)34-23/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H,30,33)
InChIKey ZDOFQHDLYXNTEB-UHFFFAOYSA-N
Mol Weight 481.5 g/mol
Molecular Formula C24H18F3N5OS
Exact Mass 481.118416 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2TYUK2hUqEe
Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[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/C24H18F3N5OS/c25-24(26,27)20-11-17(14-7-3-1-4-8-14)29-21-12-18(31-32(20)21)22(33)30-23-16(13-28)15-9-5-2-6-10-19(15)34-23/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H,30,33)
InChIKey ZDOFQHDLYXNTEB-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9533
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/8014507; Labnumber: IDV-0003867; UZI_ID: UZI-009535
Temperature 308 °C