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

Systemtic Name: 4-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2-ethyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-(1-methyl-2-oxo-2-ureido-ethyl)sulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-[[1-(carbamoylamino)-1-oxopropan-2-yl]thio]-2-ethyl-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfanyl-2-ethyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-[(2-keto-1-methyl-2-ureido-ethyl)thio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SC(C)C(=O)NC(=O)N)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SC(C)C(=O)NC(=O)N)C(=O)O)C

InChI

InChI=1S/C12H16N4O4S/c1-4-7-14-5(2)8(11(18)19)10(15-7)21-6(3)9(17)16-12(13)20/h6H,4H2,1-3H3,(H,18,19)(H3,13,16,17,20)