sodium 5-[(E)-but-2-enyl]-5-ethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: sodium 5-[(E)-but-2-enyl]-5-ethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: sodium 5-[(E)-but-2-enyl]-5-ethyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: sodium 5-[(E)-but-2-enyl]-5-ethyl-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: sodium 5-[(E)-but-2-enyl]-5-ethyl-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: sodium 5-[(E)-but-2-enyl]-5-ethyl-6-keto-2-thioxo-pyrimidin-4-olate Formula: C10H13N2NaO2S MolecularWeight: 248.27719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O2S.Na/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14;/h3,5H,4,6H2,1-2H3,(H2,11,12,13,14,15);/q;+1/p-1/b5-3+;