For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
ethyl 4-[((2Z)-3-(4-chlorobenzyl)-6-{[4-(methoxycarbonyl)anilino]carbonyl}-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene)amino]benzoate
SpectraBase Compound ID Iyzb7XKTiz2
InChI InChI=1S/C29H26ClN3O6S/c1-3-39-28(37)20-8-14-23(15-9-20)32-29-33(17-18-4-10-21(30)11-5-18)25(34)16-24(40-29)26(35)31-22-12-6-19(7-13-22)27(36)38-2/h4-15,24H,3,16-17H2,1-2H3,(H,31,35)/b32-29-
InChIKey GDVOFFLZJXVMDB-OVXWJCGASA-N
Mol Weight 580.06 g/mol
Molecular Formula C29H26ClN3O6S
Exact Mass 579.123084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3DJOPNf7g0S
Name ethyl 4-[((2Z)-3-(4-chlorobenzyl)-6-{[4-(methoxycarbonyl)anilino]carbonyl}-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/C29H26ClN3O6S/c1-3-39-28(37)20-8-14-23(15-9-20)32-29-33(17-18-4-10-21(30)11-5-18)25(34)16-24(40-29)26(35)31-22-12-6-19(7-13-22)27(36)38-2/h4-15,24H,3,16-17H2,1-2H3,(H,31,35)/b32-29-
InChIKey GDVOFFLZJXVMDB-OVXWJCGASA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18806
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: D11721; Labnumber: MPOL-13247; SBI_ID: SBI-018809
Synonyms ethyl 4-[(3-(4-chlorobenzyl)-6-{[4-(methoxycarbonyl)anilino]carbonyl}-4-oxotetrahydro-2H-1,3-thiazin-2-ylidene)amino]benzoate
Temperature 306 °C