2-[[5-[(4-ethylsulfanylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-[(4-ethylsulfanylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-[(4-ethylsulfanylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-[[4-(ethylthio)phenoxy]methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[5-[(4-ethylsulfanylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-[[4-(ethylthio)phenoxy]methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)O

Isomeric SMILES

CCSC1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)O

InChI

InChI=1S/C13H14N2O4S2/c1-2-20-10-5-3-9(4-6-10)18-7-11-14-15-13(19-11)21-8-12(16)17/h3-6H,2,7-8H2,1H3,(H,16,17)