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9-(difluoromethyl)-2-{3-[(3-methoxyphenoxy)methyl]phenyl}-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

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9-(difluoromethyl)-2-{3-[(3-methoxyphenoxy)methyl]phenyl}-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID FQrd95EpwKt
InChI InChI=1S/C26H19F2N5O2S/c1-14-9-19(23(27)28)30-26-20(14)21-22(36-26)25-31-24(32-33(25)13-29-21)16-6-3-5-15(10-16)12-35-18-8-4-7-17(11-18)34-2/h3-11,13,23H,12H2,1-2H3
InChIKey DKXNJAKZTRPOGX-UHFFFAOYSA-N
Mol Weight 503.53 g/mol
Molecular Formula C26H19F2N5O2S
Exact Mass 503.122752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HJ05p4myI2C
Name 9-(difluoromethyl)-2-{3-[(3-methoxyphenoxy)methyl]phenyl}-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
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/C26H19F2N5O2S/c1-14-9-19(23(27)28)30-26-20(14)21-22(36-26)25-31-24(32-33(25)13-29-21)16-6-3-5-15(10-16)12-35-18-8-4-7-17(11-18)34-2/h3-11,13,23H,12H2,1-2H3
InChIKey DKXNJAKZTRPOGX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32981
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: 1911848; SBI_ID: SBI-032985
Temperature 315 °C