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2-{[4-allyl-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
SpectraBase Compound ID 3ldgKlmR9CM
InChI InChI=1S/C24H23N5OS/c1-4-13-29-23(21-12-10-18-7-5-6-8-20(18)25-21)27-28-24(29)31-15-22(30)26-19-11-9-16(2)14-17(19)3/h4-12,14H,1,13,15H2,2-3H3,(H,26,30)
InChIKey SWTSURAYEJKJNG-UHFFFAOYSA-N
Mol Weight 429.54 g/mol
Molecular Formula C24H23N5OS
Exact Mass 429.162332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2HyoiYSgHiY
Name 2-{[4-allyl-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 429.162331554 u
Formula C24H23N5OS
InChI InChI=1S/C24H23N5OS/c1-4-13-29-23(21-12-10-18-7-5-6-8-20(18)25-21)27-28-24(29)31-15-22(30)26-19-11-9-16(2)14-17(19)3/h4-12,14H,1,13,15H2,2-3H3,(H,26,30)
InChIKey SWTSURAYEJKJNG-UHFFFAOYSA-N
Molecular Weight 429.542 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1254
Solvent DMSO-d6
Source Vendor ID: NMR/12269416