1-[(2S)-2-(1-adamantyl)-2-methyl-5-(4-methylphenyl)-1,3,4-oxadiazol-3-yl]ethanone

Systemtic Name: 1-[(2S)-2-(1-adamantyl)-2-methyl-5-(4-methylphenyl)-1,3,4-oxadiazol-3-yl]ethanone Openeye Name: 1-[(2S)-2-(1-adamantyl)-2-methyl-5-(p-tolyl)-1,3,4-oxadiazol-3-yl]ethanone CAS Name: 1-[(2S)-2-(1-adamantyl)-2-methyl-5-(4-methylphenyl)-1,3,4-oxadiazol-3-yl]ethanone IUPAC Name: 1-[(2S)-2-(1-adamantyl)-2-methyl-5-(4-methylphenyl)-1,3,4-oxadiazol-3-yl]ethanone Traditional Name: 1-[(2S)-2-(1-adamantyl)-2-methyl-5-(p-tolyl)-1,3,4-oxadiazol-3-yl]ethanone Formula: C22H28N2O2 MolecularWeight: 352.46992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(O2)(C)C34CC5CC(C3)CC(C5)C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN([C@](O2)(C)C34CC5CC(C3)CC(C5)C4)C(=O)C

InChI

InChI=1S/C22H28N2O2/c1-14-4-6-19(7-5-14)20-23-24(15(2)25)21(3,26-20)22-11-16-8-17(12-22)10-18(9-16)13-22/h4-7,16-18H,8-13H2,1-3H3/t16?,17?,18?,21-,22?/m0/s1