2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-ethyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-ethyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-5-ethyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-5-ethyl-6-methyl-4-pyrimidinolate IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-5-ethyl-6-methylpyrimidin-4-olate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-5-ethyl-6-methyl-pyrimidin-4-olate Formula: C9H12N3O2S- MolecularWeight: 226.27548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)N)C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)N)C

InChI

InChI=1S/C9H13N3O2S/c1-3-6-5(2)11-9(12-8(6)14)15-4-7(10)13/h3-4H2,1-2H3,(H2,10,13)(H,11,12,14)/p-1