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CHEBI:104908 - N-(1,1-dioxo-3-thiolanyl)-N-[(4-ethoxyphenyl)methyl]-2-oxo-1-benzopyran-3-carboxamide

ChEBI IDCHEBI:104908
ChEBI NameN-(1,1-dioxo-3-thiolanyl)-N-[(4-ethoxyphenyl)methyl]-2-oxo-1-benzopyran-3-carboxamide
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DownloadsMolfile
FormulaC23H23NO6S
Net Charge0
Average Mass441.505
Monoisotopic Mass441.12461
SMILESCCOc1ccc(CN(C(=O)c2cc3ccccc3oc2=O)C2CCS(=O)(=O)C2)cc1
InChIInChI=1S/C23H23NO6S/c1-2-29-19-9-7-16(8-10-19)14-24(18-11-12-31(27,28)15-18)22(25)20-13-17-5-3-4-6-21(17)30-23(20)26/h3-10,13,18H,2,11-12,14-15H2,1H3
InChIKeyPMBZLDDWVQMWSC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(1,1-dioxo-3-thiolanyl)-N-[(4-ethoxyphenyl)methyl]-2-oxo-1-benzopyran-3-carboxamide (CHEBI:104908) is a coumarins (CHEBI:23403)
Manual XrefsDatabases
LSM-16271LINCS