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CHEBI:114684 - 1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]ethanone

ChEBI IDCHEBI:114684
ChEBI Name1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]ethanone
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DownloadsMolfile
FormulaC23H24N4O3S
Net Charge0
Average Mass436.537
Monoisotopic Mass436.15691
SMILESCOc1ccc(-n2c(C)cc(C(=O)CSc3nnc(-c4ccoc4C)n3C)c2C)cc1
InChIInChI=1S/C23H24N4O3S/c1-14-12-20(15(2)27(14)17-6-8-18(29-5)9-7-17)21(28)13-31-23-25-24-22(26(23)4)19-10-11-30-16(19)3/h6-12H,13H2,1-5H3
InChIKeySDFCUWYLNZJSBK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]ethanone (CHEBI:114684) is a pyrroles (CHEBI:26455)
Manual XrefsDatabases
LSM-26146LINCS