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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(2-chlorophenoxy)ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(phenylmethyl)-, (6Z)-
SpectraBase Compound ID 6OkSlRHeqDV
InChI InChI=1S/C28H23ClN4O4S/c1-35-24-16-19(11-12-23(24)37-14-13-36-22-10-6-5-9-21(22)29)15-20-26(30)33-28(31-27(20)34)38-25(32-33)17-18-7-3-2-4-8-18/h2-12,15-16,30H,13-14,17H2,1H3/b20-15-,30-26?
InChIKey PAWAMPZNUYHRFL-ODTJMHGJSA-N
Mol Weight 547.03 g/mol
Molecular Formula C28H23ClN4O4S
Exact Mass 546.112854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID fSb6SMhWUS
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(2-chlorophenoxy)ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(phenylmethyl)-, (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/C28H23ClN4O4S/c1-35-24-16-19(11-12-23(24)37-14-13-36-22-10-6-5-9-21(22)29)15-20-26(30)33-28(31-27(20)34)38-25(32-33)17-18-7-3-2-4-8-18/h2-12,15-16,30H,13-14,17H2,1H3/b20-15-,30-26?
InChIKey PAWAMPZNUYHRFL-ODTJMHGJSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2547
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/11269214