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methyl 4-({(2Z)-6-[(2-chloroanilino)carbonyl]-3-methyl-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene}amino)benzoate
SpectraBase Compound ID FYM8gpwTNf6
InChI InChI=1S/C20H18ClN3O4S/c1-24-17(25)11-16(18(26)23-15-6-4-3-5-14(15)21)29-20(24)22-13-9-7-12(8-10-13)19(27)28-2/h3-10,16H,11H2,1-2H3,(H,23,26)/b22-20-
InChIKey FCTNYSAXMJWLSP-XDOYNYLZSA-N
Mol Weight 431.89 g/mol
Molecular Formula C20H18ClN3O4S
Exact Mass 431.070655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5HXTs0ASiai
Name methyl 4-({(2Z)-6-[(2-chloroanilino)carbonyl]-3-methyl-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/C20H18ClN3O4S/c1-24-17(25)11-16(18(26)23-15-6-4-3-5-14(15)21)29-20(24)22-13-9-7-12(8-10-13)19(27)28-2/h3-10,16H,11H2,1-2H3,(H,23,26)/b22-20-
InChIKey FCTNYSAXMJWLSP-XDOYNYLZSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18924
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: D11886; Labnumber: MPOL-16287; SBI_ID: SBI-018927
Synonyms methyl 4-({6-[(2-chloroanilino)carbonyl]-3-methyl-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene}amino)benzoate
Temperature 308 °C