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ethyl 4-{[(2Z)-6-[(3-chloroanilino)carbonyl]-3-(4-chlorobenzyl)-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
SpectraBase Compound ID 1IkNw0nNImM
InChI InChI=1S/C27H23Cl2N3O4S/c1-2-36-26(35)18-8-12-21(13-9-18)31-27-32(16-17-6-10-19(28)11-7-17)24(33)15-23(37-27)25(34)30-22-5-3-4-20(29)14-22/h3-14,23H,2,15-16H2,1H3,(H,30,34)/b31-27-
InChIKey PLJZRWFJKPAABG-QVTSOHHYSA-N
Mol Weight 556.46 g/mol
Molecular Formula C27H23Cl2N3O4S
Exact Mass 555.078633 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BJj9IAlGM9e
Name ethyl 4-{[(2Z)-6-[(3-chloroanilino)carbonyl]-3-(4-chlorobenzyl)-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/C27H23Cl2N3O4S/c1-2-36-26(35)18-8-12-21(13-9-18)31-27-32(16-17-6-10-19(28)11-7-17)24(33)15-23(37-27)25(34)30-22-5-3-4-20(29)14-22/h3-14,23H,2,15-16H2,1H3,(H,30,34)/b31-27-
InChIKey PLJZRWFJKPAABG-QVTSOHHYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2347
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: D02430; Labnumber: MPOL-13231; SBI_ID: SBI-002349
Synonyms ethyl 4-{[6-[(3-chloroanilino)carbonyl]-3-(4-chlorobenzyl)-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
Temperature 318 °C