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4-[({(2Z)-3-(4-chlorobenzyl)-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoic acid
SpectraBase Compound ID 5J5Iqi1zpUh
InChI InChI=1S/C25H19Cl2N3O4S/c26-17-5-1-15(2-6-17)14-30-22(31)13-21(35-25(30)29-20-11-7-18(27)8-12-20)23(32)28-19-9-3-16(4-10-19)24(33)34/h1-12,21H,13-14H2,(H,28,32)(H,33,34)/b29-25-
InChIKey WCVLSQACDFVQEW-GNVQSUKOSA-N
Mol Weight 528.41 g/mol
Molecular Formula C25H19Cl2N3O4S
Exact Mass 527.047333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1G1tUMqm8T
Name 4-[({3-(4-chlorobenzyl)-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
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Formula C25H19Cl2N3O4S
InChI InChI=1S/C25H19Cl2N3O4S/c26-17-5-1-15(2-6-17)14-30-22(31)13-21(35-25(30)29-20-11-7-18(27)8-12-20)23(32)28-19-9-3-16(4-10-19)24(33)34/h1-12,21H,13-14H2,(H,28,32)(H,33,34)/b29-25-
InChIKey WCVLSQACDFVQEW-GNVQSUKOSA-N
Molecular Weight 528.410 g/mol
SMILES N(C(C1CC(N(\C(S1)=N\c1ccc(cc1)Cl)Cc1ccc(cc1)Cl)=O)=O)c1ccc(C(=O)O)cc1
SPLASH splash10-004i-6920000000-f826b3facf603013ae36
Synonyms 4-[({(2Z)-3-(4-chlorobenzyl)-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzoic acid 4-[[3-(4-chloro-benzyl)-2-(4-chloro-phenylimino)-4-oxo-[1,3]thiazinane-6-carbonyl]-amino]-benzoic acid
Wiley ID 1458939