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acetamide, 2-[[4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-[7-(2-furanyl)-5,6,7,8-tetrahydro-5-oxo-2-quinazolinyl]-
SpectraBase Compound ID 9WeQ0PPx6wn
InChI InChI=1S/C23H21N7O3S/c1-2-30-21(14-5-7-24-8-6-14)28-29-23(30)34-13-20(32)27-22-25-12-16-17(26-22)10-15(11-18(16)31)19-4-3-9-33-19/h3-9,12,15H,2,10-11,13H2,1H3,(H,25,26,27,32)
InChIKey YKROXPFBPQQGAW-UHFFFAOYSA-N
Mol Weight 475.53 g/mol
Molecular Formula C23H21N7O3S
Exact Mass 475.142659 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I00jfKFWJC1
Name acetamide, 2-[[4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-[7-(2-furanyl)-5,6,7,8-tetrahydro-5-oxo-2-quinazolinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.142658735 u
Formula C23H21N7O3S
InChI InChI=1S/C23H21N7O3S/c1-2-30-21(14-5-7-24-8-6-14)28-29-23(30)34-13-20(32)27-22-25-12-16-17(26-22)10-15(11-18(16)31)19-4-3-9-33-19/h3-9,12,15H,2,10-11,13H2,1H3,(H,25,26,27,32)
InChIKey YKROXPFBPQQGAW-UHFFFAOYSA-N
Molecular Weight 475.527 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18456
Solvent DMSO-d6
Source Vendor ID: NMR/11262211; Lab Info: PRE; Lab Number: PRE-A000003