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2,8-Bis(dimethylamino)-4,6-bis(propylamino)-5-(3,4-methylenedioxyphenyl)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
SpectraBase Compound ID 7FWOgek5jGB
InChI InChI=1S/C26H34N8O2S/c1-7-11-27-21-19-18(15-9-10-16-17(13-15)36-14-35-16)20-22(28-12-8-2)30-26(34(5)6)32-24(20)37-23(19)31-25(29-21)33(3)4/h9-10,13,18H,7-8,11-12,14H2,1-6H3,(H,27,29,31)(H,28,30,32)
InChIKey ZYXDJKSKDUSXQU-UHFFFAOYSA-N
Mol Weight 522.7 g/mol
Molecular Formula C26H34N8O2S
Exact Mass 522.252544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn149XhPgtE
Name 2,8-Bis(dimethylamino)-4,6-bis(propylamino)-5-(3,4-methylenedioxyphenyl)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C26H34N8O2S
InChI InChI=1S/C26H34N8O2S/c1-7-11-27-21-19-18(15-9-10-16-17(13-15)36-14-35-16)20-22(28-12-8-2)30-26(34(5)6)32-24(20)37-23(19)31-25(29-21)33(3)4/h9-10,13,18H,7-8,11-12,14H2,1-6H3,(H,27,29,31)(H,28,30,32)
InChIKey ZYXDJKSKDUSXQU-UHFFFAOYSA-N
Molecular Weight 522.672 g/mol
SMILES N(c1nc(nc2c1C(c1c(nc(nc1NCCC)N(C)C)S2)c1cc2OCOc2cc1)N(C)C)CCC
SPLASH splash10-0udi-0000910000-ee9112fa89cab69e7731
Source of Spectrum H1-52-346-6
Synonyms 5-(1,3-benzodioxol-5-yl)-N(2),N(2),N(8),N(8)-tetramethyl-N(4),N(6)-dipropyl-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidine-2,4,6,8-tetramine N-[5-(1,3-benzodioxol-5-yl)-2,8-bis(dimethylamino)-6-(propylamino)-5H-pyrimido[5',4':5,6]thiino[2,3-d]pyrimidin-4-yl]-N-propylamine
Wiley ID 817553