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5-AMINO-2-(TERT.-BUTOXYCARBONYLMETHYLSULFANYL)-4-MORPHOLINO-THIENO-[2,3-D]-PYRIMIDIN-6-CARBOXYLIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID J0LJAay96SG
InChI InChI=1S/C21H30N4O5S2/c1-20(2,3)29-12(26)11-31-19-23-16(25-7-9-28-10-8-25)13-14(22)15(32-17(13)24-19)18(27)30-21(4,5)6/h7-11,22H2,1-6H3
InChIKey ICDNENMUSLUHTB-UHFFFAOYSA-N
Mol Weight 482.61 g/mol
Molecular Formula C21H30N4O5S2
Exact Mass 482.165762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKPxbx0iBEx
Name 5-Amino-2-[(2-tert-butoxy-2-keto-ethyl)thio]-4-morpholino-thieno[2,3-d]pyrimidine-6-carboxylic acid tert-butyl ester
Alternate Name(s) 5-Amino-2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]-4-(4-morpholinyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid tert-butyl ester tert-Butyl 5-amino-2-(2-tert-butoxy-2-oxo-ethyl)sulfanyl-4-morpholino-thieno[2,3-d]pyrimidine-6-carboxylate tert-Butyl 5-amino-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanyl-4-morpholin-4-ylthieno[2,3-d]pyrimidine-6-carboxylate tert-Butyl 5-azanyl-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-morpholin-4-yl-thieno[2,3-d]pyrimidine-6-carboxylate
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Formula C21H30N4O5S2
InChI InChI=1S/C21H30N4O5S2/c1-20(2,3)29-12(26)11-31-19-23-16(25-7-9-28-10-8-25)13-14(22)15(32-17(13)24-19)18(27)30-21(4,5)6/h7-11,22H2,1-6H3
InChIKey ICDNENMUSLUHTB-UHFFFAOYSA-N
Molecular Weight 482.614 g/mol
SMILES Nc1c2c(nc(nc2N2CCOCC2)SCC(=O)OC(C)(C)C)sc1C(=O)OC(C)(C)C
SPLASH splash10-0059-0001900000-6f055811fff17735e41a
Source of Spectrum AJ-42-845-9
Wiley ID 1568026