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2-[(2-chlorobenzyl)sulfanyl]-N-(2,4-dimethylphenyl)-5-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-

View entire compound with spectra: 1 NMR

2-[(2-chlorobenzyl)sulfanyl]-N-(2,4-dimethylphenyl)-5-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-
SpectraBase Compound ID KNZWLS7c0QX
InChI InChI=1S/C29H28ClN5OS2/c1-17-9-14-24(18(2)15-17)32-27(36)25-19(3)31-28-33-29(38-16-21-7-5-6-8-23(21)30)34-35(28)26(25)20-10-12-22(37-4)13-11-20/h5-15,26H,16H2,1-4H3,(H,32,36)(H,31,33,34)
InChIKey QBVCSTGXOPWBAW-UHFFFAOYSA-N
Mol Weight 562.15 g/mol
Molecular Formula C29H28ClN5OS2
Exact Mass 561.142381 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JHkCmEkCQPT
Name 2-[(2-chlorobenzyl)sulfanyl]-N-(2,4-dimethylphenyl)-5-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 561.142380589 u
Formula C29H28ClN5OS2
InChI InChI=1S/C29H28ClN5OS2/c1-17-9-14-24(18(2)15-17)32-27(36)25-19(3)31-28-33-29(38-16-21-7-5-6-8-23(21)30)34-35(28)26(25)20-10-12-22(37-4)13-11-20/h5-15,26H,16H2,1-4H3,(H,32,36)(H,31,33,34)
InChIKey QBVCSTGXOPWBAW-UHFFFAOYSA-N
Molecular Weight 562.150 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7990
Solvent DMSO-d6
Source Vendor ID: NMR/13218941