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

*Links on SpectraBase are not permalinks.
acetamide, 2-(4-chlorophenoxy)-N-[1-methyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-1H-benzimidazol-5-yl]-
SpectraBase Compound ID KpVufuAvj6b
InChI InChI=1S/C22H20ClN5O2S/c1-14-9-10-24-22(25-14)31-13-20-27-18-11-16(5-8-19(18)28(20)2)26-21(29)12-30-17-6-3-15(23)4-7-17/h3-11H,12-13H2,1-2H3,(H,26,29)
InChIKey WQAINLXBTOPCQI-UHFFFAOYSA-N
Mol Weight 453.95 g/mol
Molecular Formula C22H20ClN5O2S
Exact Mass 453.102624 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 5R7M7ORcGnE
Name acetamide, 2-(4-chlorophenoxy)-N-[1-methyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-1H-benzimidazol-5-yl]-
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/C22H20ClN5O2S/c1-14-9-10-24-22(25-14)31-13-20-27-18-11-16(5-8-19(18)28(20)2)26-21(29)12-30-17-6-3-15(23)4-7-17/h3-11H,12-13H2,1-2H3,(H,26,29)
InChIKey WQAINLXBTOPCQI-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2764
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: F15547; Labnumber: ZUB-S1930-0215