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

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2-(4-Chloro-phenylimino)-3-(4-methoxy-benzyl)-4-oxo-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide
SpectraBase Compound ID B2MfdIzGMx2
InChI InChI=1S/C26H21Cl2F2N3O4S/c1-36-20-10-2-16(3-11-20)15-33-23(34)14-22(38-25(33)32-19-6-4-17(27)5-7-19)24(35)31-18-8-12-21(13-9-18)37-26(28,29)30/h2-13,22H,14-15H2,1H3,(H,31,35)/b32-25-
InChIKey LANGQKRGGFYSCR-MKCFTUBBSA-N
Mol Weight 580.43 g/mol
Molecular Formula C26H21Cl2F2N3O4S
Exact Mass 579.059789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6saaPVHjyMA
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[(4-chlorophenyl)imino]tetrahydro-3-[(4-methoxyphenyl)methyl]-4-oxo-, (2Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 579.059789064 u
Formula C26H21Cl2F2N3O4S
InChI InChI=1S/C26H21Cl2F2N3O4S/c1-36-20-10-2-16(3-11-20)15-33-23(34)14-22(38-25(33)32-19-6-4-17(27)5-7-19)24(35)31-18-8-12-21(13-9-18)37-26(28,29)30/h2-13,22H,14-15H2,1H3,(H,31,35)/b32-25-
InChIKey LANGQKRGGFYSCR-MKCFTUBBSA-N
Molecular Weight 580.434 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14432
Solvent DMSO-d6
Source Vendor ID: NMR/10215668; Lab Info: PE; Lab Number: NMR/9296038