3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]benzoic acid

Systemtic Name: 3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]benzoic acid Openeye Name: 3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]benzoic acid CAS Name: 3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)thio]ethoxy]benzoic acid IUPAC Name: 3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]benzoic acid Traditional Name: 3-[2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)thio]ethoxy]benzoic acid Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(O1)SCCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=NN=C(O1)SCCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H18N2O4S/c1-15(2,3)13-16-17-14(21-13)22-8-7-20-11-6-4-5-10(9-11)12(18)19/h4-6,9H,7-8H2,1-3H3,(H,18,19)