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2H-1,3-thiazine-6-carboxamide, N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-fluorophenyl)imino]tetrahydro-4-oxo-3-(2-phenylethyl)-, (2Z)-
SpectraBase Compound ID TI1NbumKB5
InChI InChI=1S/C31H34FN3O4S/c1-3-38-26-15-10-23(20-27(26)39-4-2)16-18-33-30(37)28-21-29(36)35(19-17-22-8-6-5-7-9-22)31(40-28)34-25-13-11-24(32)12-14-25/h5-15,20,28H,3-4,16-19,21H2,1-2H3,(H,33,37)/b34-31-
InChIKey LPOLJNVSFFEFFO-NMSHJFGGSA-N
Mol Weight 563.7 g/mol
Molecular Formula C31H34FN3O4S
Exact Mass 563.225406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yXDz2l0amD
Name 2-(4-Fluoro-phenylimino)-4-oxo-3-phenethyl-[1,3]thiazinane-6-carboxylic acid [2-(3,4-diethoxy-phenyl)-ethyl]-amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34FN3O4S
InChI InChI=1S/C31H34FN3O4S/c1-3-38-26-15-10-23(20-27(26)39-4-2)16-18-33-30(37)28-21-29(36)35(19-17-22-8-6-5-7-9-22)31(40-28)34-25-13-11-24(32)12-14-25/h5-15,20,28H,3-4,16-19,21H2,1-2H3,(H,33,37)/b34-31-
InChIKey LPOLJNVSFFEFFO-NMSHJFGGSA-N
Molecular Weight 563.688 g/mol
SMILES N(C(C1CC(N(\C(S1)=N\c1ccc(cc1)F)CCc1ccccc1)=O)=O)CCc1cc(OCC)c(cc1)OCC
SPLASH splash10-0006-1900000000-14134cb1ff3a07fdd004
Synonyms (2Z)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-fluorophenyl)imino]-4-oxo-3-(2-phenylethyl)tetrahydro-2H-1,3-thiazine-6-carboxamide N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-fluorophenyl)imino]-4-oxo-3-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
Wiley ID 1463558