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isopropyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

View entire compound with spectra: 1 NMR

isopropyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID HkVTgVuKkLw
InChI InChI=1S/C26H24F2N4O3S/c1-14(2)35-26(34)21-16-10-6-7-11-20(16)36-25(21)31-24(33)17-13-29-32-19(22(27)28)12-18(30-23(17)32)15-8-4-3-5-9-15/h3-5,8-9,12-14,22H,6-7,10-11H2,1-2H3,(H,31,33)
InChIKey HYLBXTKSXQVLEL-UHFFFAOYSA-N
Mol Weight 510.56 g/mol
Molecular Formula C26H24F2N4O3S
Exact Mass 510.153718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cp009LBOxwk
Name isopropyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[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/C26H24F2N4O3S/c1-14(2)35-26(34)21-16-10-6-7-11-20(16)36-25(21)31-24(33)17-13-29-32-19(22(27)28)12-18(30-23(17)32)15-8-4-3-5-9-15/h3-5,8-9,12-14,22H,6-7,10-11H2,1-2H3,(H,31,33)
InChIKey HYLBXTKSXQVLEL-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1649
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: 9312220; UBI_ID: UBI-001650
Temperature 308 °C