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CHEBI:105460 - 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-3-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone

ChEBI IDCHEBI:105460
ChEBI Name2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-3-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone
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DownloadsMolfile
FormulaC21H23N3O2S2
Net Charge0
Average Mass413.568
Monoisotopic Mass413.12317
SMILESCCn1c(SCC(=O)N2CCc3ccccc3C2)nc2sc(C)c(C)c2c1=O
InChIInChI=1S/C21H23N3O2S2/c1-4-24-20(26)18-13(2)14(3)28-19(18)22-21(24)27-12-17(25)23-10-9-15-7-5-6-8-16(15)11-23/h5-8H,4,9-12H2,1-3H3
InChIKeyKDGSYBWZDAMPRM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-3-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone (CHEBI:105460) is a isoquinolines (CHEBI:24922)
Manual XrefsDatabases
LSM-16823LINCS