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

View entire compound with spectra: 1 NMR

ethyl 2-({[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 1qdRvax4UGw
InChI InChI=1S/C25H24BrF3N4O3S/c1-2-36-24(35)21-15-5-3-4-6-18(15)37-23(21)31-22(34)17-12-20-30-16(13-7-9-14(26)10-8-13)11-19(25(27,28)29)33(20)32-17/h7-10,12,16,19,30H,2-6,11H2,1H3,(H,31,34)
InChIKey XCSLDPYJAUPMJN-UHFFFAOYSA-N
Mol Weight 597.45 g/mol
Molecular Formula C25H24BrF3N4O3S
Exact Mass 596.070459 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FG6AsOhxrJV
Name ethyl 2-({[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-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/C25H24BrF3N4O3S/c1-2-36-24(35)21-15-5-3-4-6-18(15)37-23(21)31-22(34)17-12-20-30-16(13-7-9-14(26)10-8-13)11-19(25(27,28)29)33(20)32-17/h7-10,12,16,19,30H,2-6,11H2,1H3,(H,31,34)
InChIKey XCSLDPYJAUPMJN-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12389
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/9120283; UBI_ID: UBI-012392
Temperature 308 °C