sodium 5-ethyl-5-(1-pentylsulfanylethyl)pyrimidin-3-ide-2,4,6-trione

Systemtic Name: sodium 5-ethyl-5-(1-pentylsulfanylethyl)pyrimidin-3-ide-2,4,6-trione Openeye Name: sodium 5-ethyl-5-(1-pentylsulfanylethyl)hexahydropyrimidin-3-ide-2,4,6-trione CAS Name: sodium 5-ethyl-5-[1-(pentylthio)ethyl]pyrimidin-3-ide-2,4,6-trione IUPAC Name: sodium 5-ethyl-5-(1-pentylsulfanylethyl)pyrimidin-3-ide-2,4,6-trione Traditional Name: sodium 5-[1-(amylthio)ethyl]-5-ethyl-hexahydropyrimidin-3-ide-2,4,6-trione Formula: C13H21N2NaO3S MolecularWeight: 308.37221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O3S.Na/c1-4-6-7-8-19-9(3)13(5-2)10(16)14-12(18)15-11(13)17;/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18);/q;+1/p-1