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CHEBI:112450 - 3-[5-(4-acetylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid

ChEBI IDCHEBI:112450
ChEBI Name3-[5-(4-acetylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid
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DownloadsMolfile
FormulaC18H15N3O4S
Net Charge0
Average Mass369.402
Monoisotopic Mass369.07833
SMILESCC(=O)c1ccc(-c2ccc(C=C(Sc3nnc(C)n3)C(=O)O)o2)cc1
InChIInChI=1S/C18H15N3O4S/c1-10(22)12-3-5-13(6-4-12)15-8-7-14(25-15)9-16(17(23)24)26-18-19-11(2)20-21-18/h3-9H,1-2H3,(H,23,24)(H,19,20,21)
InChIKeyZJTDNRKDJAKASB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[5-(4-acetylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid (CHEBI:112450) is a aromatic ketone (CHEBI:76224)
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LSM-23862LINCS