N,N-dimethyl-3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N,N-dimethyl-3-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-carbonyl]-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N,N-dimethyl-3-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-carbonyl]-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 3-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-carbonyl]-N,N-dimethyl-4-pyrrolidino-benzenesulfonamide Formula: C23H36N5O5S+ MolecularWeight: 494.62744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C23H35N5O5S/c1-24(2)34(31,32)19-5-6-21(26-7-3-4-8-26)20(17-19)23(30)28-11-9-25(10-12-28)18-22(29)27-13-15-33-16-14-27/h5-6,17H,3-4,7-16,18H2,1-2H3/p+1