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

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ethyl 7-(4-bromophenyl)-5-methyl-2-[(2-naphthylmethyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID v5p54CL0co
InChI InChI=1S/C26H23BrN4O2S/c1-3-33-24(32)22-16(2)28-25-29-26(30-31(25)23(22)19-10-12-21(27)13-11-19)34-15-17-8-9-18-6-4-5-7-20(18)14-17/h4-14,23H,3,15H2,1-2H3,(H,28,29,30)
InChIKey MCXBONWMBFKBSI-UHFFFAOYSA-N
Mol Weight 535.46 g/mol
Molecular Formula C26H23BrN4O2S
Exact Mass 534.07251 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DmRhrKJgkiO
Name ethyl 7-(4-bromophenyl)-5-methyl-2-[(2-naphthylmethyl)sulfanyl]-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 534.072510169 u
Formula C26H23BrN4O2S
InChI InChI=1S/C26H23BrN4O2S/c1-3-33-24(32)22-16(2)28-25-29-26(30-31(25)23(22)19-10-12-21(27)13-11-19)34-15-17-8-9-18-6-4-5-7-20(18)14-17/h4-14,23H,3,15H2,1-2H3,(H,28,29,30)
InChIKey MCXBONWMBFKBSI-UHFFFAOYSA-N
Molecular Weight 535.460 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6700
Solvent DMSO-d6
Source Vendor ID: NMR/12329026