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ethyl 4-{[(2Z)-3-methyl-4-oxo-6-(3-toluidinocarbonyl)tetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
SpectraBase Compound ID 9brIS64WZms
InChI InChI=1S/C22H23N3O4S/c1-4-29-21(28)15-8-10-16(11-9-15)24-22-25(3)19(26)13-18(30-22)20(27)23-17-7-5-6-14(2)12-17/h5-12,18H,4,13H2,1-3H3,(H,23,27)/b24-22-
InChIKey URQUGTZPXFXYAK-GYHWCHFESA-N
Mol Weight 425.5 g/mol
Molecular Formula C22H23N3O4S
Exact Mass 425.140927 g/mol
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1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KqBqzUuIPmW
Name ethyl 4-{[(2Z)-3-methyl-4-oxo-6-(3-toluidinocarbonyl)tetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H23N3O4S/c1-4-29-21(28)15-8-10-16(11-9-15)24-22-25(3)19(26)13-18(30-22)20(27)23-17-7-5-6-14(2)12-17/h5-12,18H,4,13H2,1-3H3,(H,23,27)/b24-22-
InChIKey URQUGTZPXFXYAK-GYHWCHFESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24125
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: D44388; Labnumber: MPOL-0204; SBI_ID: SBI-024129
Synonyms ethyl 4-{[3-methyl-4-oxo-6-(3-toluidinocarbonyl)tetrahydro-2H-1,3-thiazin-2-ylidene]amino}benzoate
Temperature 318 °C
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