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CHEBI:114951 - 1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]ethanone

ChEBI IDCHEBI:114951
ChEBI Name1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]ethanone
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DownloadsMolfile
FormulaC21H19N3O3S2
Net Charge0
Average Mass425.535
Monoisotopic Mass425.08678
SMILESCOc1ccc(-n2c(C)cc(C(=O)CSc3nnc(-c4cccs4)o3)c2C)cc1
InChIInChI=1S/C21H19N3O3S2/c1-13-11-17(14(2)24(13)15-6-8-16(26-3)9-7-15)18(25)12-29-21-23-22-20(27-21)19-5-4-10-28-19/h4-11H,12H2,1-3H3
InChIKeyJLYSXIINKUKSSB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]ethanone (CHEBI:114951) is a pyrroles (CHEBI:26455)
Manual XrefsDatabases
LSM-26414LINCS