6-(methoxymethyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-(methoxymethyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-pyrimidin-4-olate Openeye Name: 6-(methoxymethyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-pyrimidin-4-olate CAS Name: 6-(methoxymethyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 6-(methoxymethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylpyrimidin-4-olate Traditional Name: 2-[(2-keto-2-morpholino-ethyl)thio]-6-(methoxymethyl)pyrimidin-4-olate Formula: C12H16N3O4S- MolecularWeight: 298.33814

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=NC(=N1)SCC(=O)N2CCOCC2)[O-]

Isomeric SMILES

COCC1=CC(=NC(=N1)SCC(=O)N2CCOCC2)[O-]

InChI

InChI=1S/C12H17N3O4S/c1-18-7-9-6-10(16)14-12(13-9)20-8-11(17)15-2-4-19-5-3-15/h6H,2-5,7-8H2,1H3,(H,13,14,16)/p-1