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

*Links on SpectraBase are not permalinks.

2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide

View entire compound with spectra: 1 NMR

2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide
SpectraBase Compound ID 3TUvNzeeTQN
InChI InChI=1S/C20H18N6O2S3/c27-15(23-19-25-22-11-30-19)10-29-20-24-17-16(13-3-1-2-4-14(13)31-17)18(28)26(20)9-12-5-7-21-8-6-12/h5-8,11H,1-4,9-10H2,(H,23,25,27)
InChIKey NDDCIAYXYFSWCN-UHFFFAOYSA-N
Mol Weight 470.58 g/mol
Molecular Formula C20H18N6O2S3
Exact Mass 470.065337 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 6jcMFFhcJUD
Name 2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide
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/C20H18N6O2S3/c27-15(23-19-25-22-11-30-19)10-29-20-24-17-16(13-3-1-2-4-14(13)31-17)18(28)26(20)9-12-5-7-21-8-6-12/h5-8,11H,1-4,9-10H2,(H,23,25,27)
InChIKey NDDCIAYXYFSWCN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8068
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/1268449; Labnumber: COL6710; UZI_ID: UZI-008070
Temperature 318 °C