cyclohexyl 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: cyclohexyl 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(4-tert-butylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid cyclohexyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)OC3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)OC3CCCCC3

InChI

InChI=1S/C21H28N2O4S/c1-21(2,3)15-9-11-16(12-10-15)25-13-18-22-23-20(27-18)28-14-19(24)26-17-7-5-4-6-8-17/h9-12,17H,4-8,13-14H2,1-3H3