6-methyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[[2-(methylamino)-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-(methylamino)-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(methylamino)ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C8H10N3O2S- MolecularWeight: 212.2489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N3O2S/c1-5-3-6(12)11-8(10-5)14-4-7(13)9-2/h3H,4H2,1-2H3,(H,9,13)(H,10,11,12)/p-1