sodium 5-(butylsulfanylmethyl)-5-ethyl-1-methyl-4,6-bis(oxidanylidene)pyrimidin-2-olate

Systemtic Name: sodium 5-(butylsulfanylmethyl)-5-ethyl-1-methyl-4,6-bis(oxidanylidene)pyrimidin-2-olate Openeye Name: sodium 5-(butylsulfanylmethyl)-5-ethyl-1-methyl-4,6-dioxo-pyrimidin-2-olate CAS Name: sodium 5-[(butylthio)methyl]-5-ethyl-1-methyl-4,6-dioxo-2-pyrimidinolate IUPAC Name: sodium 5-(butylsulfanylmethyl)-5-ethyl-1-methyl-4,6-dioxopyrimidin-2-olate Traditional Name: sodium 5-[(butylthio)methyl]-5-ethyl-4,6-diketo-1-methyl-pyrimidin-2-olate Formula: C12H19N2NaO3S MolecularWeight: 294.34563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1(C(=O)N=C(N(C1=O)C)[O-])CC.[Na+]

Isomeric SMILES

CCCCSCC1(C(=O)N=C(N(C1=O)C)[O-])CC.[Na+]

InChI

InChI=1S/C12H20N2O3S.Na/c1-4-6-7-18-8-12(5-2)9(15)13-11(17)14(3)10(12)16;/h4-8H2,1-3H3,(H,13,15,17);/q;+1/p-1