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ethyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 2NqOsktfgnI
InChI InChI=1S/C26H24F2N4O3S/c1-3-35-26(34)21-16-10-9-14(2)11-20(16)36-25(21)31-24(33)17-13-29-32-19(22(27)28)12-18(30-23(17)32)15-7-5-4-6-8-15/h4-8,12-14,22H,3,9-11H2,1-2H3,(H,31,33)
InChIKey GZMKKOXCXUUFFI-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 DZInFKqS7C
Name ethyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-methyl-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/c1-3-35-26(34)21-16-10-9-14(2)11-20(16)36-25(21)31-24(33)17-13-29-32-19(22(27)28)12-18(30-23(17)32)15-7-5-4-6-8-15/h4-8,12-14,22H,3,9-11H2,1-2H3,(H,31,33)
InChIKey GZMKKOXCXUUFFI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1486
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 9312023; UBI_ID: UBI-001487
Temperature 308 °C