For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
pyrazolo[1,5-a]pyrimidin-7(4H)-one, 5-[[(4-chlorophenyl)thio]methyl]-3-(3,4-dimethoxyphenyl)-2-methyl-
SpectraBase Compound ID 1a84I4Eh2U6
InChI InChI=1S/C22H20ClN3O3S/c1-13-21(14-4-9-18(28-2)19(10-14)29-3)22-24-16(11-20(27)26(22)25-13)12-30-17-7-5-15(23)6-8-17/h4-11,24H,12H2,1-3H3
InChIKey YAOGAVUZVHDSIE-UHFFFAOYSA-N
Mol Weight 441.93 g/mol
Molecular Formula C22H20ClN3O3S
Exact Mass 441.09139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9V353EaUDaH
Name pyrazolo[1,5-a]pyrimidin-7(4H)-one, 5-[[(4-chlorophenyl)thio]methyl]-3-(3,4-dimethoxyphenyl)-2-methyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H20ClN3O3S/c1-13-21(14-4-9-18(28-2)19(10-14)29-3)22-24-16(11-20(27)26(22)25-13)12-30-17-7-5-15(23)6-8-17/h4-11,24H,12H2,1-3H3
InChIKey YAOGAVUZVHDSIE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5961
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F26565; Labnumber: VGU-S1059-0866