3-(2-methylpropyl)-5-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-methylpropyl)-5-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-isobutyl-5-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-methylpropyl)-5-[[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methylpropyl)-5-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-isobutyl-5-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]-1,2,4-oxadiazole Formula: C18H23F3N4O3S MolecularWeight: 432.46043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)CC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H23F3N4O3S/c1-13(2)11-16-22-17(28-23-16)12-24-7-9-25(10-8-24)29(26,27)15-5-3-14(4-6-15)18(19,20)21/h3-6,13H,7-12H2,1-2H3