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6-Chloro-2,8-di(dimethylamino)-5-phenyl-4-propylamino-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
SpectraBase Compound ID 4EpK5j1p2cc
InChI InChI=1S/C22H26ClN7S/c1-6-12-24-18-16-14(13-10-8-7-9-11-13)15-17(23)25-21(29(2)3)27-19(15)31-20(16)28-22(26-18)30(4)5/h7-11,14H,6,12H2,1-5H3,(H,24,26,28)
InChIKey BOLABAQDNNCFGX-UHFFFAOYSA-N
Mol Weight 456.01 g/mol
Molecular Formula C22H26ClN7S
Exact Mass 455.165893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5zTtjOB99f
Name 6-Chloro-2,8-di(dimethylamino)-5-phenyl-4-propylamino-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C22H26ClN7S
InChI InChI=1S/C22H26ClN7S/c1-6-12-24-18-16-14(13-10-8-7-9-11-13)15-17(23)25-21(29(2)3)27-19(15)31-20(16)28-22(26-18)30(4)5/h7-11,14H,6,12H2,1-5H3,(H,24,26,28)
InChIKey BOLABAQDNNCFGX-UHFFFAOYSA-N
Molecular Weight 456.012 g/mol
SMILES N(c1nc(nc2Sc3nc(N(C)C)nc(c3C(c3ccccc3)c12)Cl)N(C)C)CCC
SPLASH splash10-004i-0009300000-1a1894f2489d99cf3b1d
Source of Spectrum H1-52-344-5
Synonyms 6-chloro-N(2),N(2),N(8),N(8)-tetramethyl-5-phenyl-N(4)-propyl-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidine-2,4,8-triamine N-[6-chloro-2,8-bis(dimethylamino)-5-phenyl-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidin-4-yl]-N-propylamine
Wiley ID 817560