2-(1-adamantyl)-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(1-adamantyl)-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(1-adamantyl)-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(1-adamantyl)-5-[(2-methoxy-5-methylphenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(1-adamantyl)-5-[(2-methoxy-5-methylphenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(1-adamantyl)-5-[(2-methoxy-5-methyl-benzyl)thio]-1,3,4-oxadiazole Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N2O2S/c1-13-3-4-18(24-2)17(5-13)12-26-20-23-22-19(25-20)21-9-14-6-15(10-21)8-16(7-14)11-21/h3-5,14-16H,6-12H2,1-2H3