4-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-(2-oxo-2-ureido-ethyl)sulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-[[2-(carbamoylamino)-2-oxoethyl]thio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[2-(carbamoylamino)-2-oxoethyl]sulfanyl-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-keto-2-ureido-ethyl)thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C10H12N4O4S MolecularWeight: 284.29168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC(=O)NC(=O)N)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC(=O)NC(=O)N)C(=O)O

InChI

InChI=1S/C10H12N4O4S/c1-4-7(9(16)17)8(13-5(2)12-4)19-3-6(15)14-10(11)18/h3H2,1-2H3,(H,16,17)(H3,11,14,15,18)