sodium 5-ethyl-5-propan-2-yl-2-sulfanylidene-pyrimidin-3-ide-4,6-dione

Systemtic Name: sodium 5-ethyl-5-propan-2-yl-2-sulfanylidene-pyrimidin-3-ide-4,6-dione Openeye Name: sodium 5-ethyl-5-isopropyl-2-thioxo-hexahydropyrimidin-3-ide-4,6-dione CAS Name: sodium 5-ethyl-5-propan-2-yl-2-sulfanylidenepyrimidin-3-ide-4,6-dione IUPAC Name: sodium 5-ethyl-5-propan-2-yl-2-sulfanylidenepyrimidin-3-ide-4,6-dione Traditional Name: sodium 5-ethyl-5-isopropyl-2-thioxo-hexahydropyrimidin-3-ide-4,6-quinone Formula: C9H13N2NaO2S MolecularWeight: 236.26649

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=S)[N-]C1=O)C(C)C.[Na+]

Isomeric SMILES

CCC1(C(=O)NC(=S)[N-]C1=O)C(C)C.[Na+]

InChI

InChI=1S/C9H14N2O2S.Na/c1-4-9(5(2)3)6(12)10-8(14)11-7(9)13;/h5H,4H2,1-3H3,(H2,10,11,12,13,14);/q;+1/p-1