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

Systemtic Name: 2-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-phenyl-5-[[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole CAS Name: 2-[[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-phenyl-5-[(4-tosylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole Formula: C20H23N4O3S+ MolecularWeight: 399.48662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3S/c1-16-7-9-18(10-8-16)28(25,26)24-13-11-23(12-14-24)15-19-21-22-20(27-19)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3/p+1