3-(4,6-dimethylpyrimidin-2-yl)-2-oxidanylidene-1H-imidazole-5-carbothioic S-acid

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)-2-oxidanylidene-1H-imidazole-5-carbothioic S-acid Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)-2-oxo-1H-imidazole-5-carbothioic S-acid CAS Name: 3-(4,6-dimethyl-2-pyrimidinyl)-2-oxo-1H-imidazole-5-carbothioic S-acid IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)-2-oxo-1H-imidazole-5-carbothioic S-acid Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-2-keto-4-imidazoline-4-carbothioic S-acid Formula: C10H10N4O2S MolecularWeight: 250.277

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=C(NC2=O)C(=O)S)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=C(NC2=O)C(=O)S)C

InChI

InChI=1S/C10H10N4O2S/c1-5-3-6(2)12-9(11-5)14-4-7(8(15)17)13-10(14)16/h3-4H,1-2H3,(H,13,16)(H,15,17)