sodium 5,5-diethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: sodium 5,5-diethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 5,5-diethyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 5,5-diethyl-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 5,5-diethyl-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 5,5-diethyl-6-keto-2-thioxo-pyrimidin-4-olate Formula: C8H11N2NaO2S MolecularWeight: 222.23991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12N2O2S.Na/c1-3-8(4-2)5(11)9-7(13)10-6(8)12;/h3-4H2,1-2H3,(H2,9,10,11,12,13);/q;+1/p-1