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

*Links on SpectraBase are not permalinks.
thiazolo[4,5-d]pyrimidine-3-propanaminium, 6-(4-ethoxyphenyl)-N,N-diethyl-2,3,6,7-tetrahydro-5-[[2-[(3-methoxyphenyl)amino]-2-oxoethyl]thio]-7-oxo-2-thioxo-, chloride
SpectraBase Compound ID 9qhmbZtA01k
InChI InChI=1S/C29H35N5O4S3.ClH/c1-5-32(6-2)16-9-17-33-26-25(41-29(33)39)27(36)34(21-12-14-22(15-13-21)38-7-3)28(31-26)40-19-24(35)30-20-10-8-11-23(18-20)37-4;/h8,10-15,18H,5-7,9,16-17,19H2,1-4H3,(H,30,35);1H
InChIKey UYVKABBYAWMCFI-UHFFFAOYSA-N
Mol Weight 650.3 g/mol
Molecular Formula C29H36ClN5O4S3
Exact Mass 649.161796 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 7fslTK73CHn
Name thiazolo[4,5-d]pyrimidine-3-propanaminium, 6-(4-ethoxyphenyl)-N,N-diethyl-2,3,6,7-tetrahydro-5-[[2-[(3-methoxyphenyl)amino]-2-oxoethyl]thio]-7-oxo-2-thioxo-, chloride
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/C29H35N5O4S3.ClH/c1-5-32(6-2)16-9-17-33-26-25(41-29(33)39)27(36)34(21-12-14-22(15-13-21)38-7-3)28(31-26)40-19-24(35)30-20-10-8-11-23(18-20)37-4;/h8,10-15,18H,5-7,9,16-17,19H2,1-4H3,(H,30,35);1H
InChIKey UYVKABBYAWMCFI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7358
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/10328892