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

*Links on SpectraBase are not permalinks.
methyl 5-methyl-2-[({[6-methyl-4-oxo-3-(3-pyridinylmethyl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]-3-thiophenecarboxylate
SpectraBase Compound ID JGINUhPngMm
InChI InChI=1S/C22H20N4O4S3/c1-12-7-15-18(32-12)25-22(26(20(15)28)10-14-5-4-6-23-9-14)31-11-17(27)24-19-16(21(29)30-3)8-13(2)33-19/h4-9H,10-11H2,1-3H3,(H,24,27)
InChIKey LKQSCEHSDJIDSV-UHFFFAOYSA-N
Mol Weight 500.61 g/mol
Molecular Formula C22H20N4O4S3
Exact Mass 500.064669 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 179tD4yrBli
Name methyl 5-methyl-2-[({[6-methyl-4-oxo-3-(3-pyridinylmethyl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]-3-thiophenecarboxylate
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/C22H20N4O4S3/c1-12-7-15-18(32-12)25-22(26(20(15)28)10-14-5-4-6-23-9-14)31-11-17(27)24-19-16(21(29)30-3)8-13(2)33-19/h4-9H,10-11H2,1-3H3,(H,24,27)
InChIKey LKQSCEHSDJIDSV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8058
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: UZI/1269224; Labnumber: COL6693; UZI_ID: UZI-008060
Temperature 318 °C