sodium 5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: sodium 5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 5-(ethylsulfanylmethyl)-5-isobutyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 5-[(ethylthio)methyl]-5-(2-methylpropyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 5-[(ethylthio)methyl]-5-isobutyl-6-keto-2-thioxo-pyrimidin-4-olate Formula: C11H17N2NaO2S2 MolecularWeight: 296.38465

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1(C(=O)NC(=S)N=C1[O-])CC(C)C.[Na+]

Isomeric SMILES

CCSCC1(C(=O)NC(=S)N=C1[O-])CC(C)C.[Na+]

InChI

InChI=1S/C11H18N2O2S2.Na/c1-4-17-6-11(5-7(2)3)8(14)12-10(16)13-9(11)15;/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);/q;+1/p-1