4-[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid

Systemtic Name: 4-[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid Openeye Name: 4-[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 4-[[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid IUPAC Name: 4-[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid Traditional Name: 4-[[[5-[(4-ethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H18N2O4S/c1-2-13-5-9-16(10-6-13)24-11-17-20-21-19(25-17)26-12-14-3-7-15(8-4-14)18(22)23/h3-10H,2,11-12H2,1H3,(H,22,23)