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acetamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-[[5-(2-furanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID 2YA4YrUrCCo
InChI InChI=1S/C25H22N6O3S/c1-17-22(24(33)31(29(17)2)19-12-7-4-8-13-19)26-21(32)16-35-25-28-27-23(20-14-9-15-34-20)30(25)18-10-5-3-6-11-18/h3-15H,16H2,1-2H3,(H,26,32)
InChIKey IDLHNQKIBWNWMH-UHFFFAOYSA-N
Mol Weight 486.55 g/mol
Molecular Formula C25H22N6O3S
Exact Mass 486.14741 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FoTDsHKCulZ
Name acetamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-[[5-(2-furanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.147409763 u
Formula C25H22N6O3S
InChI InChI=1S/C25H22N6O3S/c1-17-22(24(33)31(29(17)2)19-12-7-4-8-13-19)26-21(32)16-35-25-28-27-23(20-14-9-15-34-20)30(25)18-10-5-3-6-11-18/h3-15H,16H2,1-2H3,(H,26,32)
InChIKey IDLHNQKIBWNWMH-UHFFFAOYSA-N
Molecular Weight 486.550 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15163
Solvent DMSO-d6
Source Vendor ID: NMR/10300079; Lab Info: LP; Lab Number: LP-205480