sodium 5-ethyl-1-methyl-5-(3-methylbutyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: sodium 5-ethyl-1-methyl-5-(3-methylbutyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 5-ethyl-5-isopentyl-1-methyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 5-ethyl-1-methyl-5-(3-methylbutyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 5-ethyl-1-methyl-5-(3-methylbutyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 5-ethyl-5-isoamyl-6-keto-1-methyl-2-thioxo-pyrimidin-4-olate Formula: C12H19N2NaO2S MolecularWeight: 278.34623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O2S.Na/c1-5-12(7-6-8(2)3)9(15)13-11(17)14(4)10(12)16;/h8H,5-7H2,1-4H3,(H,13,15,17);/q;+1/p-1