CHEBI:123428 - 3-[[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid

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ChEBI Name 3-[[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid ChEBI ID CHEBI:123428 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H14N2O3S Net Charge 0 Average Mass 326.371 Monoisotopic Mass 326.07251 InChI InChI=1S/C17H14N2O3S/c20-16(21)14-8-4-7-13(9-14)11-23-17-19-18-15(22-17)10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,20,21) InChIKey MRFYYQYSTHLYGO-UHFFFAOYSA-N SMILES C1=CC=C(C=C1)CC2=NN=C(O2)SCC3=CC=CC(=C3)C(=O)O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3-[[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid (CHEBI:123428) is a benzoic acids (CHEBI:22723) Manual Xref Database LSM-34870 LINCS View more database links