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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID UFxQHuLdxk
InChI InChI=1S/C24H22F3N5OS/c25-24(26,27)20-11-18(14-7-3-1-4-8-14)30-21-17(13-29-32(20)21)22(33)31-23-16(12-28)15-9-5-2-6-10-19(15)34-23/h1,3-4,7-8,13,18,20,30H,2,5-6,9-11H2,(H,31,33)
InChIKey VIJBQJPCSSTIMP-UHFFFAOYSA-N
Mol Weight 485.53 g/mol
Molecular Formula C24H22F3N5OS
Exact Mass 485.149716 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JoGFuDBEKTz
Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[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/C24H22F3N5OS/c25-24(26,27)20-11-18(14-7-3-1-4-8-14)30-21-17(13-29-32(20)21)22(33)31-23-16(12-28)15-9-5-2-6-10-19(15)34-23/h1,3-4,7-8,13,18,20,30H,2,5-6,9-11H2,(H,31,33)
InChIKey VIJBQJPCSSTIMP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18010
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/9098964; UBI_ID: UBI-018013
Temperature 308 °C