5-tert-butyl-3-[(4-pyridin-3-ylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 5-tert-butyl-3-[(4-pyridin-3-ylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 5-tert-butyl-3-[[4-(3-pyridylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-tert-butyl-3-[[4-(3-pyridinylsulfonyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-tert-butyl-3-[(4-pyridin-3-ylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 5-tert-butyl-3-[[4-(3-pyridylsulfonyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C16H23N5O3S MolecularWeight: 365.45052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NO1)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=NC(=NO1)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H23N5O3S/c1-16(2,3)15-18-14(19-24-15)12-20-7-9-21(10-8-20)25(22,23)13-5-4-6-17-11-13/h4-6,11H,7-10,12H2,1-3H3