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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-ethoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID 39M9PHOYjDz
InChI InChI=1S/C26H27ClN4O4S/c1-5-33-22-14-17(6-9-21(22)35-11-10-34-18-7-8-20(27)16(4)12-18)13-19-23(28)31-26(29-24(19)32)36-25(30-31)15(2)3/h6-9,12-15,28H,5,10-11H2,1-4H3/b19-13-,28-23?
InChIKey RTQXJLAGOVRYFN-VOKATDEVSA-N
Mol Weight 527.04 g/mol
Molecular Formula C26H27ClN4O4S
Exact Mass 526.144154 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FqXwkylVY2r
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-ethoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
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/C26H27ClN4O4S/c1-5-33-22-14-17(6-9-21(22)35-11-10-34-18-7-8-20(27)16(4)12-18)13-19-23(28)31-26(29-24(19)32)36-25(30-31)15(2)3/h6-9,12-15,28H,5,10-11H2,1-4H3/b19-13-,28-23?
InChIKey RTQXJLAGOVRYFN-VOKATDEVSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2641
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/11269322