pyridin-2-yl (2S)-2-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]propanedithioate

Systemtic Name: pyridin-2-yl (2S)-2-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]propanedithioate Openeye Name: 2-pyridyl (2S)-2-(1-hydroxy-2,5-dioxo-pyrrolidin-1-ium-1-yl)propanedithioate CAS Name: (2S)-2-(1-hydroxy-2,5-dioxo-1-pyrrolidin-1-iumyl)propanedithioic acid 2-pyridinyl ester IUPAC Name: pyridin-2-yl (2S)-2-(1-hydroxy-2,5-dioxopyrrolidin-1-ium-1-yl)propanedithioate Traditional Name: (2S)-2-(1-hydroxy-2,5-diketo-pyrrolidin-1-ium-1-yl)propanedithioic acid 2-pyridyl ester Formula: C12H13N2O3S2+ MolecularWeight: 297.37322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=S)SC1=CC=CC=N1)[N+]2(C(=O)CCC2=O)O

Isomeric SMILES

C[C@@H](C(=S)SC1=CC=CC=N1)[N+]2(C(=O)CCC2=O)O

InChI

InChI=1S/C12H13N2O3S2/c1-8(14(17)10(15)5-6-11(14)16)12(18)19-9-4-2-3-7-13-9/h2-4,7-8,17H,5-6H2,1H3/q+1/t8-/m0/s1