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6-AMINO-5-(1,2-(E)-DICARBOMETHOXYVINYL)-AMINO-2-METHYL-THIOPYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID FVRbNz0Hs5e
InChI InChI=1S/C11H14N4O5S/c1-19-6(16)4-5(10(18)20-2)13-7-8(12)14-11(21-3)15-9(7)17/h4,13H,1-3H3,(H3,12,14,15,17)/b5-4-
InChIKey FUAINFWCAZWQNE-PLNGDYQASA-N
Mol Weight 314.32 g/mol
Molecular Formula C11H14N4O5S
Exact Mass 314.068491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9X2IsAUgUm
Name 6-Amino-5-[1',2'-bis(methoxycarbonyl)vinyl]amino-2-(methylthio)-1,3-pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14N4O5S
InChI InChI=1S/C11H14N4O5S/c1-19-6(16)4-5(10(18)20-2)13-7-8(12)14-11(21-3)15-9(7)17/h4,13H,1-3H3,(H3,12,14,15,17)/b5-4-
InChIKey FUAINFWCAZWQNE-PLNGDYQASA-N
Molecular Weight 314.316 g/mol
SMILES N1C(=NC(=C(C1=O)N\C(=C/C(=O)OC)C(=O)OC)N)SC
SPLASH splash10-0ul0-2090000000-2187ed9d328cc8eaeea6
Source of Spectrum Y-36-436-2
Synonyms (Z)-2-[[6-amino-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]amino]-2-butenedioic acid dimethyl ester (Z)-2-[[6-amino-4-keto-2-(methylthio)-1H-pyrimidin-5-yl]amino]but-2-enedioic acid dimethyl ester Dimethyl (Z)-2-[(6-amino-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)amino]but-2-enedioate Dimethyl (Z)-2-[(6-azanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)amino]but-2-enedioate
Wiley ID 762002