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

Systemtic Name: cyclohexyl 2-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid cyclohexyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC(=O)OC3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC(=O)OC3CCCCC3)OC

InChI

InChI=1S/C18H22N2O5S/c1-22-14-9-8-12(10-15(14)23-2)17-19-20-18(25-17)26-11-16(21)24-13-6-4-3-5-7-13/h8-10,13H,3-7,11H2,1-2H3