5-ethanoyl-1,1-dimethyl-2-sulfanylidene-1,3-diazinan-1-ium-4,6-dione

Systemtic Name: 5-ethanoyl-1,1-dimethyl-2-sulfanylidene-1,3-diazinan-1-ium-4,6-dione Openeye Name: 5-acetyl-1,1-dimethyl-2-thioxo-hexahydropyrimidin-1-ium-4,6-dione CAS Name: 5-acetyl-1,1-dimethyl-2-sulfanylidene-1,3-diazinan-1-ium-4,6-dione IUPAC Name: 5-acetyl-1,1-dimethyl-2-sulfanylidene-1,3-diazinan-1-ium-4,6-dione Traditional Name: 5-acetyl-1,1-dimethyl-2-thioxo-hexahydropyrimidin-1-ium-4,6-quinone Formula: C8H11N2O3S+ MolecularWeight: 215.24954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)NC(=S)[N+](C1=O)(C)C

Isomeric SMILES

CC(=O)C1C(=O)NC(=S)[N+](C1=O)(C)C

InChI

InChI=1S/C8H10N2O3S/c1-4(11)5-6(12)9-8(14)10(2,3)7(5)13/h5H,1-3H3/p+1