2-(1-adamantylmethylsulfanyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(1-adamantylmethylsulfanyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-(1-adamantylmethylsulfanyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-(1-adamantylmethylthio)-5-(4-methoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(1-adamantylmethylsulfanyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(1-adamantylmethylthio)-5-(4-methoxyphenyl)-1,3,4-oxadiazole Formula: C20H24N2O2S MolecularWeight: 356.48176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(O2)SCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(O2)SCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H24N2O2S/c1-23-17-4-2-16(3-5-17)18-21-22-19(24-18)25-12-20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,13-15H,6-12H2,1H3