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acetic acid, [[3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,3,6,7-tetrahydro-7-oxo-2-thioxothiazolo[4,5-d]pyrimidin-5-yl]thio]-, ethyl ester

View entire compound with spectra: 1 NMR

acetic acid, [[3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,3,6,7-tetrahydro-7-oxo-2-thioxothiazolo[4,5-d]pyrimidin-5-yl]thio]-, ethyl ester
SpectraBase Compound ID LZam4A3aChd
InChI InChI=1S/C25H25N3O4S3/c1-5-31-19-11-9-17(10-12-19)28-23(30)21-22(26-24(28)34-14-20(29)32-6-2)27(25(33)35-21)18-8-7-15(3)16(4)13-18/h7-13H,5-6,14H2,1-4H3
InChIKey FSCUJAZEVWIPOY-UHFFFAOYSA-N
Mol Weight 527.67 g/mol
Molecular Formula C25H25N3O4S3
Exact Mass 527.10072 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AeUBbMAzMrY
Name acetic acid, [[3-(3,4-dimethylphenyl)-6-(4-ethoxyphenyl)-2,3,6,7-tetrahydro-7-oxo-2-thioxothiazolo[4,5-d]pyrimidin-5-yl]thio]-, 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/C25H25N3O4S3/c1-5-31-19-11-9-17(10-12-19)28-23(30)21-22(26-24(28)34-14-20(29)32-6-2)27(25(33)35-21)18-8-7-15(3)16(4)13-18/h7-13H,5-6,14H2,1-4H3
InChIKey FSCUJAZEVWIPOY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_389
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/10328031