sodium 5-ethoxycarbonyl-2-sulfanylidene-1H-pyrimidin-6-olate

Systemtic Name: sodium 5-ethoxycarbonyl-2-sulfanylidene-1H-pyrimidin-6-olate Openeye Name: sodium 5-ethoxycarbonyl-2-thioxo-1H-pyrimidin-6-olate CAS Name: sodium 5-ethoxycarbonyl-2-sulfanylidene-1H-pyrimidin-6-olate IUPAC Name: sodium 5-ethoxycarbonyl-2-sulfanylidene-1H-pyrimidin-6-olate Traditional Name: sodium 5-carbethoxy-2-thioxo-1H-pyrimidin-6-olate Formula: C7H7N2NaO3S MolecularWeight: 222.19685

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8N2O3S.Na/c1-2-12-6(11)4-3-8-7(13)9-5(4)10;/h3H,2H2,1H3,(H2,8,9,10,13);/q;+1/p-1