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2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-(4-isopropylphenyl)acetamide
SpectraBase Compound ID BjDntuR38Jx
InChI InChI=1S/C28H27N5O3S/c1-17(2)18-10-12-20(13-11-18)29-25(34)16-37-28-30-22-15-24(36-4)23(35-3)14-21(22)27-31-26(32-33(27)28)19-8-6-5-7-9-19/h5-15,17H,16H2,1-4H3,(H,29,34)
InChIKey YIRADSFXVIKCFF-UHFFFAOYSA-N
Mol Weight 513.62 g/mol
Molecular Formula C28H27N5O3S
Exact Mass 513.183461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wbB5QbKmZr
Name 2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-(4-isopropylphenyl)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 513.183460920 u
Formula C28H27N5O3S
InChI InChI=1S/C28H27N5O3S/c1-17(2)18-10-12-20(13-11-18)29-25(34)16-37-28-30-22-15-24(36-4)23(35-3)14-21(22)27-31-26(32-33(27)28)19-8-6-5-7-9-19/h5-15,17H,16H2,1-4H3,(H,29,34)
InChIKey YIRADSFXVIKCFF-UHFFFAOYSA-N
Molecular Weight 513.616 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7041
Solvent DMSO-d6
Source Vendor ID: NMR/12329526