2-(1-adamantyl)-5-[(3-methylquinoxalin-2-yl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(1-adamantyl)-5-[(3-methylquinoxalin-2-yl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(1-adamantyl)-5-[(3-methylquinoxalin-2-yl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(1-adamantyl)-5-[(3-methyl-2-quinoxalinyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(1-adamantyl)-5-[(3-methylquinoxalin-2-yl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(1-adamantyl)-5-[(3-methylquinoxalin-2-yl)methylthio]-1,3,4-oxadiazole Formula: C22H24N4OS MolecularWeight: 392.51716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(O3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(O3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H24N4OS/c1-13-19(24-18-5-3-2-4-17(18)23-13)12-28-21-26-25-20(27-21)22-9-14-6-15(10-22)8-16(7-14)11-22/h2-5,14-16H,6-12H2,1H3