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

*Links on SpectraBase are not permalinks.

3-thiophenecarboxylic acid, 2-[[[[3,4-dihydro-4-oxo-5-phenyl-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-4,5-dimethyl-, ethyl ester

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 2-[[[[3,4-dihydro-4-oxo-5-phenyl-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-4,5-dimethyl-, ethyl ester
SpectraBase Compound ID 5wFY1MKAIJy
InChI InChI=1S/C26H25N3O4S3/c1-5-12-29-24(31)21-18(17-10-8-7-9-11-17)13-34-22(21)28-26(29)35-14-19(30)27-23-20(25(32)33-6-2)15(3)16(4)36-23/h5,7-11,13H,1,6,12,14H2,2-4H3,(H,27,30)
InChIKey NGXPUPYJKQNTAE-UHFFFAOYSA-N
Mol Weight 539.68 g/mol
Molecular Formula C26H25N3O4S3
Exact Mass 539.10072 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 NtmiRdrSkP
Name 3-thiophenecarboxylic acid, 2-[[[[3,4-dihydro-4-oxo-5-phenyl-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-4,5-dimethyl-, ethyl ester
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/C26H25N3O4S3/c1-5-12-29-24(31)21-18(17-10-8-7-9-11-17)13-34-22(21)28-26(29)35-14-19(30)27-23-20(25(32)33-6-2)15(3)16(4)36-23/h5,7-11,13H,1,6,12,14H2,2-4H3,(H,27,30)
InChIKey NGXPUPYJKQNTAE-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_981
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: NMR/11228695