3-(2-methylpropyl)-5-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-methylpropyl)-5-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-isobutyl-5-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-methylpropyl)-5-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methylpropyl)-5-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-isobutyl-5-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C15H23N4O3S2+ MolecularWeight: 371.49812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CC1=NOC(=N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C15H22N4O3S2/c1-12(2)10-13-16-14(22-17-13)11-18-5-7-19(8-6-18)24(20,21)15-4-3-9-23-15/h3-4,9,12H,5-8,10-11H2,1-2H3/p+1