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ethyl 2-[(3-chlorobenzyl)sulfanyl]-7-(4-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-[(3-chlorobenzyl)sulfanyl]-7-(4-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID avpChRN260
InChI InChI=1S/C23H23ClN4O3S/c1-4-31-21(29)19-14(2)25-22-26-23(32-13-15-6-5-7-17(24)12-15)27-28(22)20(19)16-8-10-18(30-3)11-9-16/h5-12,20H,4,13H2,1-3H3,(H,25,26,27)
InChIKey JPJLNRXHPUNEMT-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 FzCy5GENXDO
Name ethyl 2-[(3-chlorobenzyl)sulfanyl]-7-(4-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(32-13-15-6-5-7-17(24)12-15)27-28(22)20(19)16-8-10-18(30-3)11-9-16/h5-12,20H,4,13H2,1-3H3,(H,25,26,27)
InChIKey JPJLNRXHPUNEMT-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_6827
Solvent DMSO-d6
Source Vendor ID: NMR/12329254