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N-[1-[(6-chloranylpyridazin-3-yl)amino]-7,7-dimethyl-2,5-bis(oxidanylidene)-6,8-dihydroquinolin-3-yl]benzamide
SpectraBase Compound ID AxFkImR9TUL
InChI InChI=1S/C22H20ClN5O3/c1-22(2)11-16-14(17(29)12-22)10-15(24-20(30)13-6-4-3-5-7-13)21(31)28(16)27-19-9-8-18(23)25-26-19/h3-10H,11-12H2,1-2H3,(H,24,30)(H,26,27)
InChIKey QKVMGRFSABHRGK-UHFFFAOYSA-N
Mol Weight 437.89 g/mol
Molecular Formula C22H20ClN5O3
Exact Mass 437.125467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Y2PLr1rvPu
Name N-[1-[(6-chloranylpyridazin-3-yl)amino]-7,7-dimethyl-2,5-bis(oxidanylidene)-6,8-dihydroquinolin-3-yl]benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C22H20ClN5O3
InChI InChI=1S/C22H20ClN5O3/c1-22(2)11-16-14(17(29)12-22)10-15(24-20(30)13-6-4-3-5-7-13)21(31)28(16)27-19-9-8-18(23)25-26-19/h3-10H,11-12H2,1-2H3,(H,24,30)(H,26,27)
InChIKey QKVMGRFSABHRGK-UHFFFAOYSA-N
Molecular Weight 437.887 g/mol
SMILES N(C1=CC2=C(N(C1=O)Nc1nnc(cc1)Cl)CC(CC2=O)(C)C)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900100000-101146f4bb7276bf5891
Source of Spectrum F-53-1388-9
Synonyms N-[1-[(6-chloro-3-pyridazinyl)amino]-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinolin-3-yl]benzamide N-[1-[(6-chloropyridazin-3-yl)amino]-2,5-diketo-7,7-dimethyl-6,8-dihydroquinolin-3-yl]benzamide N-[1-[(6-chloropyridazin-3-yl)amino]-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinolin-3-yl]benzamide
Wiley ID 800331