2-(3,4-dimethoxyphenyl)-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[(2-phenyloxazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(3,4-dimethoxyphenyl)-5-[(2-phenyl-4-oxazolyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[(2-phenyloxazol-4-yl)methylthio]-1,3,4-oxadiazole Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=COC(=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=COC(=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C20H17N3O4S/c1-24-16-9-8-14(10-17(16)25-2)19-22-23-20(27-19)28-12-15-11-26-18(21-15)13-6-4-3-5-7-13/h3-11H,12H2,1-2H3