N-ethyl-2-methyl-5-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-N-phenyl-benzenesulfonamide

Systemtic Name: N-ethyl-2-methyl-5-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-N-phenyl-benzenesulfonamide Openeye Name: N-ethyl-2-methyl-5-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carbonyl]-N-phenyl-benzenesulfonamide CAS Name: N-ethyl-2-methyl-5-[oxo-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]methyl]-N-phenylbenzenesulfonamide IUPAC Name: N-ethyl-2-methyl-5-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-carbonyl]-N-phenylbenzenesulfonamide Traditional Name: N-ethyl-5-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-carbonyl]-2-methyl-N-phenyl-benzenesulfonamide Formula: C26H35N4O4S+ MolecularWeight: 499.6455

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4)C

InChI

InChI=1S/C26H34N4O4S/c1-3-30(23-9-5-4-6-10-23)35(33,34)24-19-22(12-11-21(24)2)26(32)29-17-15-27(16-18-29)20-25(31)28-13-7-8-14-28/h4-6,9-12,19H,3,7-8,13-18,20H2,1-2H3/p+1