4-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-(1-methyl-2-oxo-2-ureido-ethyl)sulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-[[1-(carbamoylamino)-1-oxopropan-2-yl]thio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfanyl-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-keto-1-methyl-2-ureido-ethyl)thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C11H14N4O4S MolecularWeight: 298.31826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O4S/c1-4-7(10(17)18)9(14-6(3)13-4)20-5(2)8(16)15-11(12)19/h5H,1-3H3,(H,17,18)(H3,12,15,16,19)