sodium 5-(butan-2-ylsulfanylmethyl)-5-ethyl-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate

Systemtic Name: sodium 5-(butan-2-ylsulfanylmethyl)-5-ethyl-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate Openeye Name: sodium 5-ethyl-4,6-dioxo-5-(sec-butylsulfanylmethyl)-1H-pyrimidin-2-olate CAS Name: sodium 5-[(butan-2-ylthio)methyl]-5-ethyl-4,6-dioxo-1H-pyrimidin-2-olate IUPAC Name: sodium 5-(butan-2-ylsulfanylmethyl)-5-ethyl-4,6-dioxo-1H-pyrimidin-2-olate Traditional Name: sodium 5-ethyl-4,6-diketo-5-[(sec-butylthio)methyl]-1H-pyrimidin-2-olate Formula: C11H17N2NaO3S MolecularWeight: 280.31905

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC1(C(=O)NC(=NC1=O)[O-])CC.[Na+]

Isomeric SMILES

CCC(C)SCC1(C(=O)NC(=NC1=O)[O-])CC.[Na+]

InChI

InChI=1S/C11H18N2O3S.Na/c1-4-7(3)17-6-11(5-2)8(14)12-10(16)13-9(11)15;/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);/q;+1/p-1