6-methyl-2-sulfanylidene-1H-pyrimidin-4-olate; sodium; trihydrate

Systemtic Name: 6-methyl-2-sulfanylidene-1H-pyrimidin-4-olate; sodium; trihydrate Openeye Name: 6-methyl-2-thioxo-1H-pyrimidin-4-olate; sodium; trihydrate CAS Name: 6-methyl-2-sulfanylidene-1H-pyrimidin-4-olate; sodium; trihydrate IUPAC Name: 6-methyl-2-sulfanylidene-1H-pyrimidin-4-olate; sodium; trihydrate Traditional Name: 6-methyl-2-thioxo-1H-pyrimidin-4-olate; sodium; trihydrate Formula: C5H11N2NaO4S- MolecularWeight: 218.20661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=S)N1)[O-].O.O.O.[Na]

Isomeric SMILES

CC1=CC(=NC(=S)N1)[O-].O.O.O.[Na]

InChI

InChI=1S/C5H6N2OS.Na.3H2O/c1-3-2-4(8)7-5(9)6-3;;;;/h2H,1H3,(H2,6,7,8,9);;3*1H2/p-1