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2-(Diethylamino)-3-(4-methylphenyl)-6-phenyl-7-(1-piperidinyl)thieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
SpectraBase Compound ID 6FxpdtEkGKT
InChI InChI=1S/C30H32N6O2S/c1-4-33(5-2)29-31-25-23(28(38)36(29)22-16-14-20(3)15-17-22)24-26(39-25)32-30(34-18-10-7-11-19-34)35(27(24)37)21-12-8-6-9-13-21/h6,8-9,12-17H,4-5,7,10-11,18-19H2,1-3H3
InChIKey NDXUEJAXGFIEPI-UHFFFAOYSA-N
Mol Weight 540.7 g/mol
Molecular Formula C30H32N6O2S
Exact Mass 540.230745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoBMTz0WlxF
Name 2-(Diethylamino)-3-(4-methylphenyl)-6-phenyl-7-(1-piperidinyl)thieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
Alternate Name(s) 2-(diethylamino)-3-(4-methylphenyl)-6-phenyl-7-(1-piperidinyl)-3,6-dihydropyrimido[5',4':4,5]thieno[2,3-d]pyrimidine-4,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32N6O2S
InChI InChI=1S/C30H32N6O2S/c1-4-33(5-2)29-31-25-23(28(38)36(29)22-16-14-20(3)15-17-22)24-26(39-25)32-30(34-18-10-7-11-19-34)35(27(24)37)21-12-8-6-9-13-21/h6,8-9,12-17H,4-5,7,10-11,18-19H2,1-3H3
InChIKey NDXUEJAXGFIEPI-UHFFFAOYSA-N
Molecular Weight 540.686 g/mol
SMILES c12c3c(N=C(N(C3=O)c3ccccc3)N3CCCCC3)sc2N=C(N(C1=O)c1ccc(cc1)C)N(CC)CC
SPLASH splash10-000x-0802190000-7d7cdb3fdc273befa5d3
Source of Spectrum F-69-8370-12
Wiley ID 1595877