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sodium 5-ethyl-5-[1-(3-methylbutylsulfanyl)ethyl]-2-sulfanylidene-pyrimidin-3-ide-4,6-dione

sodium 5-ethyl-5-[1-(3-methylbutylsulfanyl)ethyl]-2-sulfanylidene-pyrimidin-3-ide-4,6-dione

Systemtic Name:sodium 5-ethyl-5-[1-(3-methylbutylsulfanyl)ethyl]-2-sulfanylidene-pyrimidin-3-ide-4,6-dione
Openeye Name:sodium 5-ethyl-5-(1-isopentylsulfanylethyl)-2-thioxo-hexahydropyrimidin-3-ide-4,6-dione
CAS Name:sodium 5-ethyl-5-[1-(3-methylbutylthio)ethyl]-2-sulfanylidenepyrimidin-3-ide-4,6-dione
IUPAC Name:sodium 5-ethyl-5-[1-(3-methylbutylsulfanyl)ethyl]-2-sulfanylidenepyrimidin-3-ide-4,6-dione
Traditional Name:sodium 5-ethyl-5-[1-(isoamylthio)ethyl]-2-thioxo-hexahydropyrimidin-3-ide-4,6-quinone
Formula: C13H21N2NaO2S2
MolecularWeight: 324.43781
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H22N2O2S2.Na/c1-5-13(9(4)19-7-6-8(2)3)10(16)14-12(18)15-11(13)17;/h8-9H,5-7H2,1-4H3,(H2,14,15,16,17,18);/q;+1/p-1


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