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CHEBI:112254 - 2-[[1,3-dimethyl-7-(4-methylphenyl)-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide

ChEBI IDCHEBI:112254
ChEBI Name2-[[1,3-dimethyl-7-(4-methylphenyl)-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide
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DownloadsMolfile
FormulaC21H20N6O4S
Net Charge0
Average Mass452.496
Monoisotopic Mass452.12667
SMILESCc1ccc(-c2nc(SCC(=O)Nc3cc(C)on3)c3c(=O)n(C)c(=O)n(C)c3n2)cc1
InChIInChI=1S/C21H20N6O4S/c1-11-5-7-13(8-6-11)17-23-18-16(20(29)27(4)21(30)26(18)3)19(24-17)32-10-15(28)22-14-9-12(2)31-25-14/h5-9H,10H2,1-4H3,(H,22,25,28)
InChIKeyBMLWQDLTWDMAKH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[1,3-dimethyl-7-(4-methylphenyl)-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:112254) is a aromatic amide (CHEBI:62733)
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