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

Systemtic Name: sodium 5-(2-methylpropyl)-5-(methylsulfanylmethyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 5-isobutyl-5-(methylsulfanylmethyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 5-(2-methylpropyl)-5-[(methylthio)methyl]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 5-(2-methylpropyl)-5-(methylsulfanylmethyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 5-isobutyl-6-keto-5-[(methylthio)methyl]-2-thioxo-pyrimidin-4-olate Formula: C10H15N2NaO2S2 MolecularWeight: 282.35807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C(=O)NC(=S)N=C1[O-])CSC.[Na+]

Isomeric SMILES

CC(C)CC1(C(=O)NC(=S)N=C1[O-])CSC.[Na+]

InChI

InChI=1S/C10H16N2O2S2.Na/c1-6(2)4-10(5-16-3)7(13)11-9(15)12-8(10)14;/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15);/q;+1/p-1