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ethyl 3-(ethoxycarbonylamino)-4-oxo-2-thioxo-1,5,6,8-tetrahydropyrido[2,3]thieno[2,4-b]pyrimidine-7-carboxylate
SpectraBase Compound ID L0McqrKku92
InChI InChI=1S/C15H18N4O5S2/c1-3-23-14(21)17-19-12(20)10-8-5-6-18(15(22)24-4-2)7-9(8)26-11(10)16-13(19)25/h3-7H2,1-2H3,(H,16,25)(H,17,21)
InChIKey ZKZIOCHHWWKZAG-UHFFFAOYSA-N
Mol Weight 398.45 g/mol
Molecular Formula C15H18N4O5S2
Exact Mass 398.071862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Eo80xKy40f
Name ethyl 3-(ethoxycarbonylamino)-4-oxo-2-thioxo-1,5,6,8-tetrahydropyrido[2,3]thieno[2,4-b]pyrimidine-7-carboxylate
Appearance Colorless powder
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Formula C15H18N4O5S2
InChI InChI=1S/C15H18N4O5S2/c1-3-23-14(21)17-19-12(20)10-8-5-6-18(15(22)24-4-2)7-9(8)26-11(10)16-13(19)25/h3-7H2,1-2H3,(H,16,25)(H,17,21)
InChIKey ZKZIOCHHWWKZAG-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3560
Molecular Weight 398.452 g/mol
Reported Formula C15H18N4O5S2
SMILES N1c2c(C(N(C1=S)NC(OCC)=O)=O)c1c(s2)CN(CC1)C(OCC)=O
SPLASH splash10-014i-0029000000-cba7d2a0e379aa57d4ed
Source of Spectrum Y-56-SM9-6
Wiley ID 1861195