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

Systemtic Name: 2-[[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-oxadiazole Openeye Name: 2-[[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-oxadiazole CAS Name: 2-[[4-(4-cyclohexylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-5-methyl-1,3,4-oxadiazole IUPAC Name: 2-[[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-oxadiazole Traditional Name: 2-[[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-oxadiazole Formula: C20H29N4O3S+ MolecularWeight: 405.53426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CC1=NN=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C20H28N4O3S/c1-16-21-22-20(27-16)15-23-11-13-24(14-12-23)28(25,26)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h7-10,17H,2-6,11-15H2,1H3/p+1