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2-{5-[(4-chlorophenoxy)methyl]-2-furyl}-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID 8F3ANrh83Qw
InChI InChI=1S/C23H14ClF2N5O2S/c1-11-8-15(20(25)26)28-23-17(11)18-19(34-23)22-29-21(30-31(22)10-27-18)16-7-6-14(33-16)9-32-13-4-2-12(24)3-5-13/h2-8,10,20H,9H2,1H3
InChIKey KWFCKQRHWVPDNU-UHFFFAOYSA-N
Mol Weight 497.91 g/mol
Molecular Formula C23H14ClF2N5O2S
Exact Mass 497.05248 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3lDOAW7z9ht
Name 2-{5-[(4-chlorophenoxy)methyl]-2-furyl}-9-(difluoromethyl)-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/C23H14ClF2N5O2S/c1-11-8-15(20(25)26)28-23-17(11)18-19(34-23)22-29-21(30-31(22)10-27-18)16-7-6-14(33-16)9-32-13-4-2-12(24)3-5-13/h2-8,10,20H,9H2,1H3
InChIKey KWFCKQRHWVPDNU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33146
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: 1912108; SBI_ID: SBI-033150
Synonyms 4-chlorophenyl {5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl ether
Temperature 308 °C