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ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,5-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate

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ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,5-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate
SpectraBase Compound ID 2UMGOwIMFQg
InChI InChI=1S/C20H19F2N5O3S/c1-5-29-20(28)17-15(11(3)30-26-17)9-31-19-13(7-23)12(6-16(25-19)18(21)22)14-8-24-27(4)10(14)2/h6,8,18H,5,9H2,1-4H3
InChIKey NDPLFPZHPZPLNL-UHFFFAOYSA-N
Mol Weight 447.46 g/mol
Molecular Formula C20H19F2N5O3S
Exact Mass 447.117667 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CPNn63eFpEM
Name ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,5-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate
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/C20H19F2N5O3S/c1-5-29-20(28)17-15(11(3)30-26-17)9-31-19-13(7-23)12(6-16(25-19)18(21)22)14-8-24-27(4)10(14)2/h6,8,18H,5,9H2,1-4H3
InChIKey NDPLFPZHPZPLNL-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32569
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: 1870211; SBI_ID: SBI-032573
Temperature 297 °C