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6-Chloro-2,8-bis(dimethylamino)-5-(p-toll)-4-(4-piperidino)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
SpectraBase Compound ID 53WlsTcVG07
InChI InChI=1S/C25H30ClN7S/c1-14-6-8-15(9-7-14)17-18-20(16-10-12-27-13-11-16)28-24(32(2)3)30-22(18)34-23-19(17)21(26)29-25(31-23)33(4)5/h6-9,16-17,27H,10-13H2,1-5H3
InChIKey OSUKXKNQFQDIOR-UHFFFAOYSA-N
Mol Weight 496.08 g/mol
Molecular Formula C25H30ClN7S
Exact Mass 495.197193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0lXSY2Hrbo
Name 6-Chloro-2,8-bis(dimethylamino)-5-(p-toll)-4-(4-piperidino)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C25H30ClN7S
InChI InChI=1S/C25H30ClN7S/c1-14-6-8-15(9-7-14)17-18-20(16-10-12-27-13-11-16)28-24(32(2)3)30-22(18)34-23-19(17)21(26)29-25(31-23)33(4)5/h6-9,16-17,27H,10-13H2,1-5H3
InChIKey OSUKXKNQFQDIOR-UHFFFAOYSA-N
Molecular Weight 496.077 g/mol
SMILES N1CCC(CC1)c1c2c(nc(n1)N(C)C)Sc1c(C2c2ccc(cc2)C)c(nc(N(C)C)n1)Cl
SPLASH splash10-0udi-0000900000-d0a066148051c4929a97
Source of Spectrum H1-52-341-5
Synonyms 6-Chloro-2,8-bis(dimethylamino)-5-(p-tolyl)-4-(4-piperidine)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Wiley ID 817569