[2,6-bis(azanyl)-4-thiomorpholin-4-yl-pyridin-1-ium-1-yl] hydrogen sulfate hydroxide

Systemtic Name: [2,6-bis(azanyl)-4-thiomorpholin-4-yl-pyridin-1-ium-1-yl] hydrogen sulfate hydroxide Openeye Name: (2,6-diamino-4-thiomorpholino-pyridin-1-ium-1-yl) hydrogen sulfate hydroxide CAS Name: sulfuric acid (2,6-diamino-4-thiomorpholin-4-yl-1-pyridin-1-iumyl) ester hydroxide IUPAC Name: (2,6-diamino-4-thiomorpholin-4-ylpyridin-1-ium-1-yl) hydrogen sulfate hydroxide Traditional Name: sulfuric acid (2,6-diamino-4-thiomorpholino-pyridin-1-ium-1-yl) ester hydroxide Formula: C9H16N4O5S2 MolecularWeight: 324.37714

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=CC(=[N+](C(=C2)N)OS(=O)(=O)O)N.[OH-]

Isomeric SMILES

C1CSCCN1C2=CC(=[N+](C(=C2)N)OS(=O)(=O)O)N.[OH-]

InChI

InChI=1S/C9H14N4O4S2.H2O/c10-8-5-7(12-1-3-18-4-2-12)6-9(11)13(8)17-19(14,15)16;/h5-6H,1-4H2,(H4,10,11,14,15,16);1H2