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methyl 2-({[5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

View entire compound with spectra: 1 NMR

methyl 2-({[5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 8A14DJPI6t8
InChI InChI=1S/C24H18BrF3N4O3S/c1-35-23(34)19-14-4-2-3-5-17(14)36-22(19)31-21(33)15-11-29-32-18(24(26,27)28)10-16(30-20(15)32)12-6-8-13(25)9-7-12/h6-11H,2-5H2,1H3,(H,31,33)
InChIKey NTDAMUJTXSDMSF-UHFFFAOYSA-N
Mol Weight 579.39 g/mol
Molecular Formula C24H18BrF3N4O3S
Exact Mass 578.023509 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8sebEJhsUNC
Name methyl 2-({[5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C24H18BrF3N4O3S/c1-35-23(34)19-14-4-2-3-5-17(14)36-22(19)31-21(33)15-11-29-32-18(24(26,27)28)10-16(30-20(15)32)12-6-8-13(25)9-7-12/h6-11H,2-5H2,1H3,(H,31,33)
InChIKey NTDAMUJTXSDMSF-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9636
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/8099450; Labnumber: IDV-5005; UZI_ID: UZI-009638
Temperature 308 °C