sodium 1,5-dimethyl-6-oxidanylidene-5-pentan-2-yl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: sodium 1,5-dimethyl-6-oxidanylidene-5-pentan-2-yl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 1,5-dimethyl-5-(1-methylbutyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 1,5-dimethyl-6-oxo-5-pentan-2-yl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 1,5-dimethyl-6-oxo-5-pentan-2-yl-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 6-keto-1,5-dimethyl-5-(1-methylbutyl)-2-thioxo-pyrimidin-4-olate Formula: C11H17N2NaO2S MolecularWeight: 264.31965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18N2O2S.Na/c1-5-6-7(2)11(3)8(14)12-10(16)13(4)9(11)15;/h7H,5-6H2,1-4H3,(H,12,14,16);/q;+1/p-1