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CHEBI:112996 - 4-[[5-(4-fluorophenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile

ChEBI IDCHEBI:112996
ChEBI Name4-[[5-(4-fluorophenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile
Stars
DownloadsMolfile
FormulaC19H15FN4O2S2
Net Charge0
Average Mass414.487
Monoisotopic Mass414.06205
SMILESCC(=N)C(C#N)C(=O)CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)n1C
InChIInChI=1S/C19H15FN4O2S2/c1-10(22)13(7-21)15(25)9-28-19-23-17-16(18(26)24(19)2)14(8-27-17)11-3-5-12(20)6-4-11/h3-6,8,13,22H,9H2,1-2H3
InChIKeyPZPKYIAWACKNBG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[5-(4-fluorophenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile (CHEBI:112996) is a organic heterobicyclic compound (CHEBI:27171)
4-[[5-(4-fluorophenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile (CHEBI:112996) is a organonitrogen heterocyclic compound (CHEBI:38101)
4-[[5-(4-fluorophenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile (CHEBI:112996) is a organosulfur heterocyclic compound (CHEBI:38106)
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