3-(2,2-dimethyl-4-methylsulfonyl-piperazin-1-yl)-4H-1,2,3-oxadiazol-3-ium-5-imine

Systemtic Name: 3-(2,2-dimethyl-4-methylsulfonyl-piperazin-1-yl)-4H-1,2,3-oxadiazol-3-ium-5-imine Openeye Name: 3-(2,2-dimethyl-4-methylsulfonyl-piperazin-1-yl)-4H-oxadiazol-3-ium-5-imine CAS Name: 3-(2,2-dimethyl-4-methylsulfonyl-1-piperazinyl)-4H-oxadiazol-3-ium-5-imine IUPAC Name: 3-(2,2-dimethyl-4-methylsulfonylpiperazin-1-yl)-4H-oxadiazol-3-ium-5-imine Traditional Name: [3-(4-mesyl-2,2-dimethyl-piperazino)-4H-oxadiazol-3-ium-5-ylidene]amine Formula: C9H18N5O3S+ MolecularWeight: 276.33592

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1[N+]2=NOC(=N)C2)S(=O)(=O)C)C

Isomeric SMILES

CC1(CN(CCN1[N+]2=NOC(=N)C2)S(=O)(=O)C)C

InChI

InChI=1S/C9H18N5O3S/c1-9(2)7-12(18(3,15)16)4-5-13(9)14-6-8(10)17-11-14/h10H,4-7H2,1-3H3/q+1