3-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]carbonyl-N,N-dimethyl-4-piperidin-1-yl-benzenesulfonamide

Systemtic Name: 3-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]carbonyl-N,N-dimethyl-4-piperidin-1-yl-benzenesulfonamide Openeye Name: 3-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-carbonyl]-N,N-dimethyl-4-(1-piperidyl)benzenesulfonamide CAS Name: 3-[[4-[(3S)-1,1-dioxo-3-thiolanyl]-1-piperazin-4-iumyl]-oxomethyl]-N,N-dimethyl-4-(1-piperidinyl)benzenesulfonamide IUPAC Name: 3-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-carbonyl]-N,N-dimethyl-4-piperidin-1-ylbenzenesulfonamide Traditional Name: 3-[4-[(3S)-1,1-diketothiolan-3-yl]piperazin-4-ium-1-carbonyl]-N,N-dimethyl-4-piperidino-benzenesulfonamide Formula: C22H35N4O5S2+ MolecularWeight: 499.6671

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N3CC[NH+](CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N3CC[NH+](CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C22H34N4O5S2/c1-23(2)33(30,31)19-6-7-21(25-9-4-3-5-10-25)20(16-19)22(27)26-13-11-24(12-14-26)18-8-15-32(28,29)17-18/h6-7,16,18H,3-5,8-15,17H2,1-2H3/p+1/t18-/m0/s1