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ethyl 4-[({(2Z)-3-benzyl-2-[(4-methoxyphenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoate
SpectraBase Compound ID CCZMUsHS7bm
InChI InChI=1S/C28H27N3O5S/c1-3-36-27(34)20-9-11-21(12-10-20)29-26(33)24-17-25(32)31(18-19-7-5-4-6-8-19)28(37-24)30-22-13-15-23(35-2)16-14-22/h4-16,24H,3,17-18H2,1-2H3,(H,29,33)/b30-28-
InChIKey WZWWQEWEOHELQN-HYOGKJQXSA-N
Mol Weight 517.6 g/mol
Molecular Formula C28H27N3O5S
Exact Mass 517.167142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2BDTyoZs81K
Name ethyl 4-[({(2Z)-3-benzyl-2-[(4-methoxyphenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoate
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/C28H27N3O5S/c1-3-36-27(34)20-9-11-21(12-10-20)29-26(33)24-17-25(32)31(18-19-7-5-4-6-8-19)28(37-24)30-22-13-15-23(35-2)16-14-22/h4-16,24H,3,17-18H2,1-2H3,(H,29,33)/b30-28-
InChIKey WZWWQEWEOHELQN-HYOGKJQXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2329
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: D02411; Labnumber: MPOL-12464; SBI_ID: SBI-002331
Synonyms ethyl 4-[({3-benzyl-2-[(4-methoxyphenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoate
Temperature 318 °C