2-(4-methylsulfonylphenyl)-5-(phenylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(4-methylsulfonylphenyl)-5-(phenylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-benzylsulfanyl-5-(4-methylsulfonylphenyl)-1,3,4-oxadiazole CAS Name: 2-(4-methylsulfonylphenyl)-5-(phenylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-benzylsulfanyl-5-(4-methylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-(benzylthio)-5-(4-mesylphenyl)-1,3,4-oxadiazole Formula: C16H14N2O3S2 MolecularWeight: 346.42396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S2/c1-23(19,20)14-9-7-13(8-10-14)15-17-18-16(21-15)22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3