2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-6-methyl-pyrimidin-4-olate Formula: C7H8N3O2S- MolecularWeight: 198.22232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N)[O-]

InChI

InChI=1S/C7H9N3O2S/c1-4-2-6(12)10-7(9-4)13-3-5(8)11/h2H,3H2,1H3,(H2,8,11)(H,9,10,12)/p-1