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N-[2,5-diketo-7-methyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-ylamino)-7,8-dihydro-6H-quinolin-3-yl]benzamide
SpectraBase Compound ID CHGMznucF2N
InChI InChI=1S/C22H19N7O3/c1-13-9-17-15(18(30)10-13)11-16(24-21(31)14-5-3-2-4-6-14)22(32)29(17)27-19-7-8-20-25-23-12-28(20)26-19/h2-8,11-13H,9-10H2,1H3,(H,24,31)(H,26,27)
InChIKey FIQOUVNZHYEUEB-UHFFFAOYSA-N
Mol Weight 429.44 g/mol
Molecular Formula C22H19N7O3
Exact Mass 429.154937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IGgZ6oI9ZCk
Name N-[2,5-diketo-7-methyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-ylamino)-7,8-dihydro-6H-quinolin-3-yl]benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C22H19N7O3
InChI InChI=1S/C22H19N7O3/c1-13-9-17-15(18(30)10-13)11-16(24-21(31)14-5-3-2-4-6-14)22(32)29(17)27-19-7-8-20-25-23-12-28(20)26-19/h2-8,11-13H,9-10H2,1H3,(H,24,31)(H,26,27)
InChIKey FIQOUVNZHYEUEB-UHFFFAOYSA-N
Molecular Weight 429.440 g/mol
SMILES N(C1=CC2=C(N(C1=O)NC1=N[n]3cnnc3C=C1)CC(CC2=O)C)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900200000-174754dd5309d59575e0
Source of Spectrum O1-59-134-14
Synonyms N-[7-methyl-2,5-bis(oxidanylidene)-1-([1,2,4]triazolo[4,3-b]pyridazin-6-ylamino)-7,8-dihydro-6H-quinolin-3-yl]benzamide N-[7-methyl-2,5-dioxo-1-([1,2,4]triazolo[4,3-b]pyridazin-6-ylamino)-7,8-dihydro-6H-quinolin-3-yl]benzamide
Wiley ID 1591881