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CHEBI:116752 - 1-[(4-fluorophenyl)-oxomethyl]-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]-2-azepanone

ChEBI IDCHEBI:116752
ChEBI Name1-[(4-fluorophenyl)-oxomethyl]-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]-2-azepanone
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FormulaC24H21FN4O2S
Net Charge0
Average Mass448.523
Monoisotopic Mass448.13693
SMILESCc1cc2nnc(SC3CCCCN(C(=O)c4ccc(F)cc4)C3=O)n2c2ccccc12
InChIInChI=1S/C24H21FN4O2S/c1-15-14-21-26-27-24(29(21)19-7-3-2-6-18(15)19)32-20-8-4-5-13-28(23(20)31)22(30)16-9-11-17(25)12-10-16/h2-3,6-7,9-12,14,20H,4-5,8,13H2,1H3
InChIKeyRIWDNPWRWRQCDB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(4-fluorophenyl)-oxomethyl]-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]-2-azepanone (CHEBI:116752) is a quinolines (CHEBI:26513)
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LSM-28204LINCS