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2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamide
SpectraBase Compound ID HsRqTNmvffQ
InChI InChI=1S/C28H27N5O4S/c1-5-24(27(34)29-18-12-9-13-19(14-18)35-2)38-28-30-21-16-23(37-4)22(36-3)15-20(21)26-31-25(32-33(26)28)17-10-7-6-8-11-17/h6-16,24H,5H2,1-4H3,(H,29,34)
InChIKey KESARNHFGMKBSQ-UHFFFAOYSA-N
Mol Weight 529.62 g/mol
Molecular Formula C28H27N5O4S
Exact Mass 529.178376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BcqbufxFeUb
Name 2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 529.178375539 u
Formula C28H27N5O4S
InChI InChI=1S/C28H27N5O4S/c1-5-24(27(34)29-18-12-9-13-19(14-18)35-2)38-28-30-21-16-23(37-4)22(36-3)15-20(21)26-31-25(32-33(26)28)17-10-7-6-8-11-17/h6-16,24H,5H2,1-4H3,(H,29,34)
InChIKey KESARNHFGMKBSQ-UHFFFAOYSA-N
Molecular Weight 529.615 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7042
Solvent DMSO-d6
Source Vendor ID: NMR/12329527