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2-chloro-7-(4-fluorophenyl)-6-(2-thienyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-yl methyl sulfide

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2-chloro-7-(4-fluorophenyl)-6-(2-thienyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-yl methyl sulfide
SpectraBase Compound ID Dh37yvvJHyJ
InChI InChI=1S/C23H16ClFN4OS2/c1-31-23-27-22-26-19-15-11-13(24)6-9-16(15)30-21(17-3-2-10-32-17)18(19)20(29(22)28-23)12-4-7-14(25)8-5-12/h2-11,20-21H,1H3,(H,26,27,28)
InChIKey XKBNDJNPXFJSNN-UHFFFAOYSA-N
Mol Weight 482.98 g/mol
Molecular Formula C23H16ClFN4OS2
Exact Mass 482.043809 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 49GKXxplX50
Name 2-chloro-7-(4-fluorophenyl)-6-(2-thienyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-yl methyl sulfide
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/C23H16ClFN4OS2/c1-31-23-27-22-26-19-15-11-13(24)6-9-16(15)30-21(17-3-2-10-32-17)18(19)20(29(22)28-23)12-4-7-14(25)8-5-12/h2-11,20-21H,1H3,(H,26,27,28)
InChIKey XKBNDJNPXFJSNN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26999
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: D69926; Labnumber: EXRud0249; SBI_ID: SBI-027003
Synonyms 2-chloro-7-(4-fluorophenyl)-10-(methylsulfanyl)-6-(2-thienyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Temperature 318 °C