2-(3,4-dimethoxyphenyl)-5-[4-(phenylsulfonyl)phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[4-(phenylsulfonyl)phenyl]-1,3,4-oxadiazole Openeye Name: 2-[4-(benzenesulfonyl)phenyl]-5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[4-(benzenesulfonyl)phenyl]-5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[4-(benzenesulfonyl)phenyl]-5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(4-besylphenyl)-5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazole Formula: C22H18N2O5S MolecularWeight: 422.45372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H18N2O5S/c1-27-19-13-10-16(14-20(19)28-2)22-24-23-21(29-22)15-8-11-18(12-9-15)30(25,26)17-6-4-3-5-7-17/h3-14H,1-2H3