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thiazolo[4,5-d]pyrimidin-7(6H)-one, 5-[(1,3-dioxolan-2-ylmethyl)thio]-6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,3-dihydro-2-thioxo-

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thiazolo[4,5-d]pyrimidin-7(6H)-one, 5-[(1,3-dioxolan-2-ylmethyl)thio]-6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,3-dihydro-2-thioxo-
SpectraBase Compound ID 9EDTruXvRWw
InChI InChI=1S/C25H25N3O4S3/c1-3-16-5-7-17(8-6-16)27-22-21(35-25(27)33)23(29)28(18-9-11-19(12-10-18)30-4-2)24(26-22)34-15-20-31-13-14-32-20/h5-12,20H,3-4,13-15H2,1-2H3
InChIKey BTGBERFPXGSMBI-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 2yxiVyVLx46
Name thiazolo[4,5-d]pyrimidin-7(6H)-one, 5-[(1,3-dioxolan-2-ylmethyl)thio]-6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,3-dihydro-2-thioxo-
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/c1-3-16-5-7-17(8-6-16)27-22-21(35-25(27)33)23(29)28(18-9-11-19(12-10-18)30-4-2)24(26-22)34-15-20-31-13-14-32-20/h5-12,20H,3-4,13-15H2,1-2H3
InChIKey BTGBERFPXGSMBI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7049
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/10328269