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ethyl 5-methyl-2-[(2-naphthylmethyl)sulfanyl]-7-(2-thienyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID K5kiIn46pNU
InChI InChI=1S/C24H22N4O2S2/c1-3-30-22(29)20-15(2)25-23-26-24(27-28(23)21(20)19-9-6-12-31-19)32-14-16-10-11-17-7-4-5-8-18(17)13-16/h4-13,21H,3,14H2,1-2H3,(H,25,26,27)
InChIKey QJWRYFRVUFGSPZ-UHFFFAOYSA-N
Mol Weight 462.59 g/mol
Molecular Formula C24H22N4O2S2
Exact Mass 462.118418 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 69DvTrTRslQ
Name ethyl 5-methyl-2-[(2-naphthylmethyl)sulfanyl]-7-(2-thienyl)-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 462.118418310 u
Formula C24H22N4O2S2
InChI InChI=1S/C24H22N4O2S2/c1-3-30-22(29)20-15(2)25-23-26-24(27-28(23)21(20)19-9-6-12-31-19)32-14-16-10-11-17-7-4-5-8-18(17)13-16/h4-13,21H,3,14H2,1-2H3,(H,25,26,27)
InChIKey QJWRYFRVUFGSPZ-UHFFFAOYSA-N
Molecular Weight 462.586 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6698
Solvent DMSO-d6
Source Vendor ID: NMR/12329024