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2-{4-[(3-chloro-1-benzothien-2-yl)carbonyl]-1-piperazinyl}pyrimidine
SpectraBase Compound ID 9CxKyzOAphu
InChI InChI=1S/C17H15ClN4OS/c18-14-12-4-1-2-5-13(12)24-15(14)16(23)21-8-10-22(11-9-21)17-19-6-3-7-20-17/h1-7H,8-11H2
InChIKey YHHUVJDWPFGKMW-UHFFFAOYSA-N
Mol Weight 358.85 g/mol
Molecular Formula C17H15ClN4OS
Exact Mass 358.06551 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A94iaYEjsJs
Name 2-{4-[(3-chloro-1-benzothien-2-yl)carbonyl]-1-piperazinyl}pyrimidine
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/C17H15ClN4OS/c18-14-12-4-1-2-5-13(12)24-15(14)16(23)21-8-10-22(11-9-21)17-19-6-3-7-20-17/h1-7H,8-11H2
InChIKey YHHUVJDWPFGKMW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20876
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: UZI/8193586; Labnumber: VAD0011184; UZI_ID: UZI-020884
Temperature 306 °C