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CHEBI:120824 - 3-[5-(5-chloro-2-methylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid

ChEBI IDCHEBI:120824
ChEBI Name3-[5-(5-chloro-2-methylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid
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DownloadsMolfile
FormulaC17H14ClN3O3S
Net Charge0
Average Mass375.837
Monoisotopic Mass375.04444
SMILESCc1nnc(SC(=Cc2ccc(-c3cc(Cl)ccc3C)o2)C(=O)O)n1
InChIInChI=1S/C17H14ClN3O3S/c1-9-3-4-11(18)7-13(9)14-6-5-12(24-14)8-15(16(22)23)25-17-19-10(2)20-21-17/h3-8H,1-2H3,(H,22,23)(H,19,20,21)
InChIKeyHAQIFVQHRZHBAY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[5-(5-chloro-2-methylphenyl)-2-furanyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid (CHEBI:120824) is a aryl sulfide (CHEBI:35683)
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