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2-({4-[chloro(difluoro)methoxy]phenyl}imino)-N-(3,4-dichlorophenyl)-4-oxo-3-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
SpectraBase Compound ID JjDXe3ZThiv
InChI InChI=1S/C26H20Cl3F2N3O3S/c27-20-11-8-18(14-21(20)28)32-24(36)22-15-23(35)34(13-12-16-4-2-1-3-5-16)25(38-22)33-17-6-9-19(10-7-17)37-26(29,30)31/h1-11,14,22H,12-13,15H2,(H,32,36)/b33-25+
InChIKey NZMBSCKEHUFBMT-INKHBPHZSA-N
Mol Weight 598.88 g/mol
Molecular Formula C26H20Cl3F2N3O3S
Exact Mass 597.025902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBLANU4TML7
Name 2-({4-[chloro(difluoro)methoxy]phenyl}imino)-N-(3,4-dichlorophenyl)-4-oxo-3-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
Alternate Name(s) (2E)-2-({4-[chloro(difluoro)methoxy]phenyl}imino)-N-(3,4-dichlorophenyl)-4-oxo-3-(2-phenylethyl)tetrahydro-2H-1,3-thiazine-6-carboxamide 2-[4-(chloro-difluoro-methoxy)-phenylimino]-4-oxo-3-phenethyl-[1,3]thiazinane-6-carboxylic acid (3,4-dichloro-phenyl)-amide
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Formula C26H20Cl3F2N3O3S
InChI InChI=1S/C26H20Cl3F2N3O3S/c27-20-11-8-18(14-21(20)28)32-24(36)22-15-23(35)34(13-12-16-4-2-1-3-5-16)25(38-22)33-17-6-9-19(10-7-17)37-26(29,30)31/h1-11,14,22H,12-13,15H2,(H,32,36)/b33-25+
InChIKey NZMBSCKEHUFBMT-INKHBPHZSA-N
Molecular Weight 598.880 g/mol
SMILES N(C(C1CC(N(\C(S1)=N/c1ccc(OC(F)(F)Cl)cc1)CCc1ccccc1)=O)=O)c1cc(Cl)c(cc1)Cl
SPLASH splash10-0pb9-3934100000-d5a94f9da513c2af9b81
Wiley ID 1463445