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

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5,6-dimethyl-pyrimidin-4-olate Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-5,6-dimethyl-pyrimidin-4-olate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-5,6-dimethyl-4-pyrimidinolate IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-5,6-dimethylpyrimidin-4-olate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-5,6-dimethyl-pyrimidin-4-olate Formula: C8H10N3O2S- MolecularWeight: 212.2489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1[O-])SCC(=O)N)C

Isomeric SMILES

CC1=C(N=C(N=C1[O-])SCC(=O)N)C

InChI

InChI=1S/C8H11N3O2S/c1-4-5(2)10-8(11-7(4)13)14-3-6(9)12/h3H2,1-2H3,(H2,9,12)(H,10,11,13)/p-1