(3S)-3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]thiolane 1,1-dioxide

Systemtic Name: (3S)-3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]thiolane 1,1-dioxide Openeye Name: (3S)-3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]thiolane 1,1-dioxide CAS Name: (3S)-3-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]thiolane 1,1-dioxide Traditional Name: (3S)-3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]sulfolane Formula: C16H25N2O4S2+ MolecularWeight: 373.5107

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C16H24N2O4S2/c1-13-3-4-14(2)16(11-13)24(21,22)18-8-6-17(7-9-18)15-5-10-23(19,20)12-15/h3-4,11,15H,5-10,12H2,1-2H3/p+1/t15-/m0/s1