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ETHYL-9-(4-METHOXYPHENYL)-7-METHYL-2,4-DITHIOXO-2,3,4,9-TETRAHYDRO-1H-THIAZOLO-[3,2-A:4,5-D']-DIPYRIMIDINE-8-CARBOXYLATE
SpectraBase Compound ID HtCFY2mCFdV
InChI InChI=1S/C19H18N4O3S3/c1-4-26-17(24)12-9(2)20-19-23(13(12)10-5-7-11(25-3)8-6-10)15-14(29-19)16(27)22-18(28)21-15/h5-8,13H,4H2,1-3H3,(H2,21,22,27,28)
InChIKey VBJYOBYJUGEHHZ-UHFFFAOYSA-N
Mol Weight 446.56 g/mol
Molecular Formula C19H18N4O3S3
Exact Mass 446.054104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPC6xNFy2WS
Name ETHYL-9-(4-METHOXYPHENYL)-7-METHYL-2,4-DITHIOXO-2,3,4,9-TETRAHYDRO-1H-THIAZOLO-[3,2-A:4,5-D']-DIPYRIMIDINE-8-CARBOXYLATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18N4O3S3
InChI InChI=1S/C19H18N4O3S3/c1-4-26-17(24)12-9(2)20-19-23(13(12)10-5-7-11(25-3)8-6-10)15-14(29-19)16(27)22-18(28)21-15/h5-8,13H,4H2,1-3H3,(H2,21,22,27,28)
InChIKey VBJYOBYJUGEHHZ-UHFFFAOYSA-N
Literature Reference Author M.M.YOUSSEF,M.A.AMIN
Literature Reference Citation MOLECULES,17,9652(2012)
Literature Reference DOI 10.3390/molecules17089652
Molecular Weight 446.557 g/mol
Sample ID 1392
Solvent DMSO-D6