5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-tert-butyl-3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C19H26N4O5S MolecularWeight: 422.49854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NO1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)C1=NC(=NO1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H26N4O5S/c1-19(2,3)18-20-17(21-28-18)13-22-6-8-23(9-7-22)29(24,25)14-4-5-15-16(12-14)27-11-10-26-15/h4-5,12H,6-11,13H2,1-3H3