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5-(4-bromophenyl)-3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

View entire compound with spectra: 1 NMR

5-(4-bromophenyl)-3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID LcSXltDF5Vo
InChI InChI=1S/C23H18BrClF3N5OS/c24-12-7-5-11(6-8-12)15-9-17(23(26,27)28)33-20(30-15)18(25)19(32-33)21(34)31-22-14(10-29)13-3-1-2-4-16(13)35-22/h5-8,15,17,30H,1-4,9H2,(H,31,34)
InChIKey OODAWVXUHZKNGA-UHFFFAOYSA-N
Mol Weight 584.84 g/mol
Molecular Formula C23H18BrClF3N5OS
Exact Mass 583.005607 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ul9WraUyUV
Name 5-(4-bromophenyl)-3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[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/C23H18BrClF3N5OS/c24-12-7-5-11(6-8-12)15-9-17(23(26,27)28)33-20(30-15)18(25)19(32-33)21(34)31-22-14(10-29)13-3-1-2-4-16(13)35-22/h5-8,15,17,30H,1-4,9H2,(H,31,34)
InChIKey OODAWVXUHZKNGA-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12324
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/9100262; UBI_ID: UBI-012327
Temperature 308 °C