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benzoic acid, 4-[[[(2E)-2-[(4-chlorophenyl)imino]tetrahydro-4-oxo-3-(phenylmethyl)-2H-1,3-thiazin-6-yl]carbonyl]amino]-
SpectraBase Compound ID 2u6WrnhFYlW
InChI InChI=1S/C25H20ClN3O4S/c26-18-8-12-20(13-9-18)28-25-29(15-16-4-2-1-3-5-16)22(30)14-21(34-25)23(31)27-19-10-6-17(7-11-19)24(32)33/h1-13,21H,14-15H2,(H,27,31)(H,32,33)/b28-25+
InChIKey TWQUPFJDEWSWDO-AZPGRJICSA-N
Mol Weight 493.97 g/mol
Molecular Formula C25H20ClN3O4S
Exact Mass 493.086305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNyt914oWef
Name 4-[({3-benzyl-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
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Formula C25H20ClN3O4S
InChI InChI=1S/C25H20ClN3O4S/c26-18-8-12-20(13-9-18)28-25-29(15-16-4-2-1-3-5-16)22(30)14-21(34-25)23(31)27-19-10-6-17(7-11-19)24(32)33/h1-13,21H,14-15H2,(H,27,31)(H,32,33)/b28-25+
InChIKey TWQUPFJDEWSWDO-AZPGRJICSA-N
Molecular Weight 493.965 g/mol
SMILES N(C(C1CC(N(\C(S1)=N/c1ccc(cc1)Cl)Cc1ccccc1)=O)=O)c1ccc(C(=O)O)cc1
SPLASH splash10-0006-9200000000-a8521b222f7666bbda20
Synonyms 4-[({(2E)-3-benzyl-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoic acid 4-[[3-benzyl-2-(4-chloro-phenylimino)-4-oxo-[1,3]thiazinane-6-carbonyl]-amino]-benzoic acid
Wiley ID 1459376