sodium (E)-(4-azanyl-2-sulfanylidene-pyrimidin-5-ylidene)methanolate

Systemtic Name: sodium (E)-(4-azanyl-2-sulfanylidene-pyrimidin-5-ylidene)methanolate Openeye Name: sodium (E)-(4-amino-2-thioxo-pyrimidin-5-ylidene)methanolate CAS Name: sodium (E)-(4-amino-2-sulfanylidene-5-pyrimidinylidene)methanolate IUPAC Name: sodium (E)-(4-amino-2-sulfanylidenepyrimidin-5-ylidene)methanolate Traditional Name: sodium (E)-(4-amino-2-thioxo-pyrimidin-5-ylidene)methanolate Formula: C5H4N3NaOS MolecularWeight: 177.15953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C\1=NC(=S)N=C(/C1=C/[O-])N.[Na+]

InChI

InChI=1S/C5H5N3OS.Na/c6-4-3(2-9)1-7-5(10)8-4;/h1-2,9H,(H2,6,8,10);/q;+1/p-1/b3-2+;