2-chloranyl-5-(3-ethyl-2-methylimino-4-oxidanyl-3-phenethyl-1,3-thiazolidin-3-ium-4-yl)benzenesulfonamide

Systemtic Name: 2-chloranyl-5-(3-ethyl-2-methylimino-4-oxidanyl-3-phenethyl-1,3-thiazolidin-3-ium-4-yl)benzenesulfonamide Openeye Name: 2-chloro-5-(3-ethyl-4-hydroxy-2-methylimino-3-phenethyl-thiazolidin-3-ium-4-yl)benzenesulfonamide CAS Name: 2-chloro-5-(3-ethyl-4-hydroxy-2-methylimino-3-phenethyl-4-thiazolidin-3-iumyl)benzenesulfonamide IUPAC Name: 2-chloro-5-(3-ethyl-4-hydroxy-2-methylimino-3-phenethyl-1,3-thiazolidin-3-ium-4-yl)benzenesulfonamide Traditional Name: 2-chloro-5-(3-ethyl-4-hydroxy-2-methylimino-3-phenethyl-thiazolidin-3-ium-4-yl)benzenesulfonamide Formula: C20H25ClN3O3S2+ MolecularWeight: 455.0138

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=NC)SCC1(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O)CCC3=CC=CC=C3

Isomeric SMILES

CC[N+]1(C(=NC)SCC1(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H25ClN3O3S2/c1-3-24(12-11-15-7-5-4-6-8-15)19(23-2)28-14-20(24,25)16-9-10-17(21)18(13-16)29(22,26)27/h4-10,13,25H,3,11-12,14H2,1-2H3,(H2,22,26,27)/q+1