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CHEBI:121765 - 4-oxo-3-phenyl-1-phthalazinecarboxylic acid [2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester

ChEBI IDCHEBI:121765
ChEBI Name4-oxo-3-phenyl-1-phthalazinecarboxylic acid [2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester
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DownloadsMolfile
FormulaC21H19N3O6S
Net Charge0
Average Mass441.465
Monoisotopic Mass441.09946
SMILESO=C(COC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12)NC1CCS(=O)(=O)C1
InChIInChI=1S/C21H19N3O6S/c25-18(22-14-10-11-31(28,29)13-14)12-30-21(27)19-16-8-4-5-9-17(16)20(26)24(23-19)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,22,25)
InChIKeyLDVMGQIHEPYHJY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-oxo-3-phenyl-1-phthalazinecarboxylic acid [2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester (CHEBI:121765) is a phthalazines (CHEBI:38768)
Manual XrefsDatabases
LSM-33208LINCS