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2,4-Bis(4-chlorobenzoyl)-7-chloro-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazole
SpectraBase Compound ID 8rJOl3wPeQT
InChI InChI=1S/C25H16Cl3NO2S/c26-17-5-1-14(2-6-17)23(30)16-11-20(24(31)15-3-7-18(27)8-4-15)25-29(13-16)21-10-9-19(28)12-22(21)32-25/h1-10,12,16H,11,13H2
InChIKey HYTSRFZIDCXKPV-UHFFFAOYSA-N
Mol Weight 500.83 g/mol
Molecular Formula C25H16Cl3NO2S
Exact Mass 498.996733 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CJ7FzYAqhh
Name 2,4-Bis(4-chlorobenzoyl)-7-chloro-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazole
Alternate Name(s) [7-chloro-2-(4-chlorobenzoyl)-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazol-4-yl](4-chlorophenyl)methanone [7-chloro-4-[(4-chlorophenyl)-oxomethyl]-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl]-(4-chlorophenyl)methanone [7-chloranyl-4-(4-chlorophenyl)carbonyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl]-(4-chlorophenyl)methanone
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Formula C25H16Cl3NO2S
InChI InChI=1S/C25H16Cl3NO2S/c26-17-5-1-14(2-6-17)23(30)16-11-20(24(31)15-3-7-18(27)8-4-15)25-29(13-16)21-10-9-19(28)12-22(21)32-25/h1-10,12,16H,11,13H2
InChIKey HYTSRFZIDCXKPV-UHFFFAOYSA-N
Molecular Weight 500.827 g/mol
SMILES C=12Sc3c(N2CC(CC1C(c1ccc(cc1)Cl)=O)C(c1ccc(cc1)Cl)=O)ccc(c3)Cl
SPLASH splash10-03di-0609010000-387cc2559d7d5e806be2
Source of Spectrum K-2002-558-3
Wiley ID 1580841