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ethyl 2-[(2-chlorobenzyl)sulfanyl]-7-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

View entire compound with spectra: 1 NMR

ethyl 2-[(2-chlorobenzyl)sulfanyl]-7-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID KFOb64C6svl
InChI InChI=1S/C23H23ClN4O3S/c1-4-31-21(29)19-14(2)25-22-26-23(32-13-15-9-5-7-11-17(15)24)27-28(22)20(19)16-10-6-8-12-18(16)30-3/h5-12,20H,4,13H2,1-3H3,(H,25,26,27)
InChIKey XPDOCGBASHWCBV-UHFFFAOYSA-N
Mol Weight 470.98 g/mol
Molecular Formula C23H23ClN4O3S
Exact Mass 470.117939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 60IwMeCEZbh
Name ethyl 2-[(2-chlorobenzyl)sulfanyl]-7-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.117939488 u
Formula C23H23ClN4O3S
InChI InChI=1S/C23H23ClN4O3S/c1-4-31-21(29)19-14(2)25-22-26-23(32-13-15-9-5-7-11-17(15)24)27-28(22)20(19)16-10-6-8-12-18(16)30-3/h5-12,20H,4,13H2,1-3H3,(H,25,26,27)
InChIKey XPDOCGBASHWCBV-UHFFFAOYSA-N
Molecular Weight 470.975 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6673
Solvent DMSO-d6
Source Vendor ID: NMR/12328984