2-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridazine-3,6-dione

Systemtic Name: 2-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridazine-3,6-dione Openeye Name: 2-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridazine-3,6-dione CAS Name: 2-(4-thiomorpholin-4-iumylmethyl)-1H-pyridazine-3,6-dione IUPAC Name: 2-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridazine-3,6-dione Traditional Name: 2-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridazine-3,6-quinone Formula: C9H14N3O2S+ MolecularWeight: 228.29136

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CN2C(=O)C=CC(=O)N2

Isomeric SMILES

C1CSCC[NH+]1CN2C(=O)C=CC(=O)N2

InChI

InChI=1S/C9H13N3O2S/c13-8-1-2-9(14)12(10-8)7-11-3-5-15-6-4-11/h1-2H,3-7H2,(H,10,13)/p+1