2-(5-chloranyl-2-methoxy-phenyl)-5-(phenylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(5-chloranyl-2-methoxy-phenyl)-5-(phenylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-benzylsulfanyl-5-(5-chloro-2-methoxy-phenyl)-1,3,4-oxadiazole CAS Name: 2-(5-chloro-2-methoxyphenyl)-5-(phenylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-benzylsulfanyl-5-(5-chloro-2-methoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(benzylthio)-5-(5-chloro-2-methoxy-phenyl)-1,3,4-oxadiazole Formula: C16H13ClN2O2S MolecularWeight: 332.80462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NN=C(O2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NN=C(O2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H13ClN2O2S/c1-20-14-8-7-12(17)9-13(14)15-18-19-16(21-15)22-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3