4-tert-butyl-N-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-1,4-thiazinan-1-ylidene]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-1,4-thiazinan-1-ylidene]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-1,4-thiazinan-1-ylidene]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-1,4-thiazinan-1-ylidene]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-1,4-thiazinan-1-ylidene]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-1,4-thiazinan-1-ylidene]benzenesulfonamide Formula: C20H24ClF3N3O2S2+ MolecularWeight: 495.00167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N=S2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N=S2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C20H23ClF3N3O2S2/c1-19(2,3)14-4-6-16(7-5-14)31(28,29)26-30-10-8-27(9-11-30)18-17(21)12-15(13-25-18)20(22,23)24/h4-7,12-13H,8-11H2,1-3H3/p+1