S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] 4-methoxy-2-oxidanyl-benzenecarbothioate

Systemtic Name: S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] 4-methoxy-2-oxidanyl-benzenecarbothioate Openeye Name: S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-hydroxy-4-methoxy-benzenecarbothioate CAS Name: 2-hydroxy-4-methoxybenzenecarbothioic acid S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-hydroxy-4-methoxybenzenecarbothioate Traditional Name: 2-hydroxy-4-methoxy-thiobenzoic acid S-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl] ester Formula: C18H16N2O6S MolecularWeight: 388.39444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)SC2=NN=C(O2)C3=C(C=C(C=C3)OC)OC)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)SC2=NN=C(O2)C3=C(C=C(C=C3)OC)OC)O

InChI

InChI=1S/C18H16N2O6S/c1-23-10-4-6-12(14(21)8-10)17(22)27-18-20-19-16(26-18)13-7-5-11(24-2)9-15(13)25-3/h4-9,21H,1-3H3