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2-(Di-n-butylamino)-3-(4-methylphenyl)-6-phenyl-7-(4-morpholinyl)thieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
SpectraBase Compound ID GZZe09zNatN
InChI InChI=1S/C33H38N6O3S/c1-4-6-17-36(18-7-5-2)32-34-28-27(31(41)39(32)25-15-13-23(3)14-16-25)26-29(43-28)35-33(37-19-21-42-22-20-37)38(30(26)40)24-11-9-8-10-12-24/h8-16H,4-7,17-22H2,1-3H3
InChIKey RXELTXJCVOQZAH-UHFFFAOYSA-N
Mol Weight 598.8 g/mol
Molecular Formula C33H38N6O3S
Exact Mass 598.27261 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bqVyxCsDrV
Name 2-(Di-n-butylamino)-3-(4-methylphenyl)-6-phenyl-7-(4-morpholinyl)thieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
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Formula C33H38N6O3S
InChI InChI=1S/C33H38N6O3S/c1-4-6-17-36(18-7-5-2)32-34-28-27(31(41)39(32)25-15-13-23(3)14-16-25)26-29(43-28)35-33(37-19-21-42-22-20-37)38(30(26)40)24-11-9-8-10-12-24/h8-16H,4-7,17-22H2,1-3H3
InChIKey RXELTXJCVOQZAH-UHFFFAOYSA-N
Molecular Weight 598.766 g/mol
SMILES c12c3c(N=C(N(C3=O)c3ccccc3)N3CCOCC3)sc2N=C(N(C1=O)c1ccc(cc1)C)N(CCCC)CCCC
SPLASH splash10-0fbi-9607340000-180dde561246237a6ad8
Source of Spectrum F-69-8371-12
Synonyms 2-(dibutylamino)-3-(4-methylphenyl)-7-(4-morpholinyl)-6-phenyl-3,6-dihydropyrimido[5',4':4,5]thieno[2,3-d]pyrimidine-4,5-dione
Wiley ID 1595872