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methyl 2-({[5-(4-methoxyphenyl)-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-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID DChWpVEZvUk
InChI InChI=1S/C25H21F3N4O4S/c1-35-14-9-7-13(8-10-14)17-11-19(25(26,27)28)32-21(30-17)16(12-29-32)22(33)31-23-20(24(34)36-2)15-5-3-4-6-18(15)37-23/h7-12H,3-6H2,1-2H3,(H,31,33)
InChIKey MUZVYZOOWGUVFH-UHFFFAOYSA-N
Mol Weight 530.52 g/mol
Molecular Formula C25H21F3N4O4S
Exact Mass 530.123561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ZMiIJMgnAu
Name methyl 2-({[5-(4-methoxyphenyl)-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/C25H21F3N4O4S/c1-35-14-9-7-13(8-10-14)17-11-19(25(26,27)28)32-21(30-17)16(12-29-32)22(33)31-23-20(24(34)36-2)15-5-3-4-6-18(15)37-23/h7-12H,3-6H2,1-2H3,(H,31,33)
InChIKey MUZVYZOOWGUVFH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9563
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/8049986; Labnumber: IDV-0004480; UZI_ID: UZI-009565
Temperature 318 °C