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3-[2-(3,4-dimethoxy-phenyl)-ethyl]-2-(4-methoxy-phenylimino)-4-oxo-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide

View entire compound with spectra: 1 NMR, and 2 MS (GC)

3-[2-(3,4-dimethoxy-phenyl)-ethyl]-2-(4-methoxy-phenylimino)-4-oxo-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide
SpectraBase Compound ID BQOEOlkKnT9
InChI InChI=1S/C29H28ClF2N3O6S/c1-38-21-9-5-20(6-10-21)34-28-35(15-14-18-4-13-23(39-2)24(16-18)40-3)26(36)17-25(42-28)27(37)33-19-7-11-22(12-8-19)41-29(30,31)32/h4-13,16,25H,14-15,17H2,1-3H3,(H,33,37)/b34-28-
InChIKey SNALKDPOKNDVPR-BFYITVNDSA-N
Mol Weight 620.07 g/mol
Molecular Formula C29H28ClF2N3O6S
Exact Mass 619.135541 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HtKcu31t8nH
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]tetrahydro-2-[(4-methoxyphenyl)imino]-4-oxo-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 619.135540828 u
Formula C29H28ClF2N3O6S
InChI InChI=1S/C29H28ClF2N3O6S/c1-38-21-9-5-20(6-10-21)34-28-35(15-14-18-4-13-23(39-2)24(16-18)40-3)26(36)17-25(42-28)27(37)33-19-7-11-22(12-8-19)41-29(30,31)32/h4-13,16,25H,14-15,17H2,1-3H3,(H,33,37)/b34-28-
InChIKey SNALKDPOKNDVPR-BFYITVNDSA-N
Molecular Weight 620.068 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14433
Solvent DMSO-d6
Source Vendor ID: NMR/10215673; Lab Info: PE; Lab Number: NMR/9296047