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CHEBI:115046 - 2-[[5-(7-methoxy-2-benzofuranyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone

ChEBI IDCHEBI:115046
ChEBI Name2-[[5-(7-methoxy-2-benzofuranyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone
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FormulaC23H21N3O4S
Net Charge0
Average Mass435.505
Monoisotopic Mass435.12528
SMILESC=CCn1c(SCC(=O)c2ccc(OC)cc2)nnc1-c1cc2cccc(OC)c2o1
InChIInChI=1S/C23H21N3O4S/c1-4-12-26-22(20-13-16-6-5-7-19(29-3)21(16)30-20)24-25-23(26)31-14-18(27)15-8-10-17(28-2)11-9-15/h4-11,13H,1,12,14H2,2-3H3
InChIKeyBFNRLDJAXRLKKI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[5-(7-methoxy-2-benzofuranyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone (CHEBI:115046) is a aromatic ketone (CHEBI:76224)
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