[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-thiophen-2-ylbutanoate

Systemtic Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-thiophen-2-ylbutanoate Openeye Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-(2-thienyl)butanoate CAS Name: 4-thiophen-2-ylbutanoic acid [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-thiophen-2-ylbutanoate Traditional Name: 4-(2-thienyl)butyric acid [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)COC(=O)CCCC3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)COC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C20H22N2O6S/c1-24-15-10-13(11-16(25-2)19(15)26-3)20-22-21-17(28-20)12-27-18(23)8-4-6-14-7-5-9-29-14/h5,7,9-11H,4,6,8,12H2,1-3H3