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

*Links on SpectraBase are not permalinks.

3-thiophenecarboxylic acid, 4-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, methyl ester

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 4-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID Dlgs0W7QrXM
InChI InChI=1S/C24H21N3O3S3/c1-30-24(29)20-16(14-7-3-2-4-8-14)11-31-23(20)27-18(28)12-32-21-19-15-9-5-6-10-17(15)33-22(19)26-13-25-21/h2-4,7-8,11,13H,5-6,9-10,12H2,1H3,(H,27,28)
InChIKey QXWYZWCPTUVGJC-UHFFFAOYSA-N
Mol Weight 495.63 g/mol
Molecular Formula C24H21N3O3S3
Exact Mass 495.074505 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 KWkgoP9U1Oa
Name 3-thiophenecarboxylic acid, 4-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, methyl 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/C24H21N3O3S3/c1-30-24(29)20-16(14-7-3-2-4-8-14)11-31-23(20)27-18(28)12-32-21-19-15-9-5-6-10-17(15)33-22(19)26-13-25-21/h2-4,7-8,11,13H,5-6,9-10,12H2,1H3,(H,27,28)
InChIKey QXWYZWCPTUVGJC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_451
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/11228081