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ethyl 4-{[(2Z)-6-[(3-ethoxyanilino)carbonyl]-3-(4-methoxybenzyl)-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
SpectraBase Compound ID JDSYev6Ie3u
InChI InChI=1S/C30H31N3O6S/c1-4-38-25-8-6-7-23(17-25)31-28(35)26-18-27(34)33(19-20-9-15-24(37-3)16-10-20)30(40-26)32-22-13-11-21(12-14-22)29(36)39-5-2/h6-17,26H,4-5,18-19H2,1-3H3,(H,31,35)/b32-30-
InChIKey VGMABKNPIGBMIO-GCUVURNUSA-N
Mol Weight 561.65 g/mol
Molecular Formula C30H31N3O6S
Exact Mass 561.193357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5CnNXL6afHE
Name ethyl 4-{[(2Z)-6-[(3-ethoxyanilino)carbonyl]-3-(4-methoxybenzyl)-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene]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/C30H31N3O6S/c1-4-38-25-8-6-7-23(17-25)31-28(35)26-18-27(34)33(19-20-9-15-24(37-3)16-10-20)30(40-26)32-22-13-11-21(12-14-22)29(36)39-5-2/h6-17,26H,4-5,18-19H2,1-3H3,(H,31,35)/b32-30-
InChIKey VGMABKNPIGBMIO-GCUVURNUSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2341
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: D02424; Labnumber: MPOL-13134; SBI_ID: SBI-002343
Synonyms ethyl 4-{[6-[(3-ethoxyanilino)carbonyl]-3-(4-methoxybenzyl)-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
Temperature 318 °C