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N-(sec-butyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
SpectraBase Compound ID JzJkx0soZ61
InChI InChI=1S/C25H27N7OS/c1-4-16(2)26-23(33)15-34-25-28-19-10-6-5-9-18(19)24-29-22(30-32(24)25)13-14-31-17(3)27-20-11-7-8-12-21(20)31/h5-12,16H,4,13-15H2,1-3H3,(H,26,33)
InChIKey XJHRQVANBVUJLE-UHFFFAOYSA-N
Mol Weight 473.6 g/mol
Molecular Formula C25H27N7OS
Exact Mass 473.19978 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7bzbf8iEzhT
Name N-(sec-butyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)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 473.199779690 u
Formula C25H27N7OS
InChI InChI=1S/C25H27N7OS/c1-4-16(2)26-23(33)15-34-25-28-19-10-6-5-9-18(19)24-29-22(30-32(24)25)13-14-31-17(3)27-20-11-7-8-12-21(20)31/h5-12,16H,4,13-15H2,1-3H3,(H,26,33)
InChIKey XJHRQVANBVUJLE-UHFFFAOYSA-N
Molecular Weight 473.599 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5384
Solvent DMSO-d6
Source Vendor ID: NMR/12319078