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6-Chloro-2,8-di(dimethylamino)-5-(4-chlorophenyl)-4-propylamino-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
SpectraBase Compound ID EbZzwP6smNG
InChI InChI=1S/C22H25Cl2N7S/c1-6-11-25-18-16-14(12-7-9-13(23)10-8-12)15-17(24)26-21(30(2)3)28-19(15)32-20(16)29-22(27-18)31(4)5/h7-10,14H,6,11H2,1-5H3,(H,25,27,29)
InChIKey AVBNLVYVXRNMHE-UHFFFAOYSA-N
Mol Weight 490.46 g/mol
Molecular Formula C22H25Cl2N7S
Exact Mass 489.12692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tkvM3QM8D7
Name 6-Chloro-2,8-di(dimethylamino)-5-(4-chlorophenyl)-4-propylamino-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C22H25Cl2N7S
InChI InChI=1S/C22H25Cl2N7S/c1-6-11-25-18-16-14(12-7-9-13(23)10-8-12)15-17(24)26-21(30(2)3)28-19(15)32-20(16)29-22(27-18)31(4)5/h7-10,14H,6,11H2,1-5H3,(H,25,27,29)
InChIKey AVBNLVYVXRNMHE-UHFFFAOYSA-N
Molecular Weight 490.457 g/mol
SMILES N(c1nc(nc2Sc3nc(N(C)C)nc(c3C(c3ccc(cc3)Cl)c12)Cl)N(C)C)CCC
SPLASH splash10-004i-0009300000-6a8b5d3da67888a070b7
Source of Spectrum H1-52-345-5
Synonyms 6-chloro-5-(4-chlorophenyl)-N(2),N(2),N(8),N(8)-tetramethyl-N(4)-propyl-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidine-2,4,8-triamine N-[6-chloro-5-(4-chlorophenyl)-2,8-bis(dimethylamino)-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidin-4-yl]-N-propylamine
Wiley ID 817558