[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-phenylsulfanylethanoate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-phenylsulfanylethanoate Openeye Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)CSC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)CSC3=CC=CC=C3)OC

InChI

InChI=1S/C19H18N2O5S/c1-23-15-9-8-13(10-16(15)24-2)19-20-17(26-21-19)11-25-18(22)12-27-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3