sodium 5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidene-pyrimidin-3-ide-4,6-dione

Systemtic Name: sodium 5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidene-pyrimidin-3-ide-4,6-dione Openeye Name: sodium 5-(3-butylsulfanylpropyl)-5-ethyl-2-thioxo-hexahydropyrimidin-3-ide-4,6-dione CAS Name: sodium 5-[3-(butylthio)propyl]-5-ethyl-2-sulfanylidenepyrimidin-3-ide-4,6-dione IUPAC Name: sodium 5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidenepyrimidin-3-ide-4,6-dione Traditional Name: sodium 5-[3-(butylthio)propyl]-5-ethyl-2-thioxo-hexahydropyrimidin-3-ide-4,6-quinone Formula: C13H21N2NaO2S2 MolecularWeight: 324.43781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCC1(C(=O)NC(=S)[N-]C1=O)CC.[Na+]

Isomeric SMILES

CCCCSCCCC1(C(=O)NC(=S)[N-]C1=O)CC.[Na+]

InChI

InChI=1S/C13H22N2O2S2.Na/c1-3-5-8-19-9-6-7-13(4-2)10(16)14-12(18)15-11(13)17;/h3-9H2,1-2H3,(H2,14,15,16,17,18);/q;+1/p-1