6-methyl-4-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-(1,1-dimethylpropylamino)-2-oxo-ethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-4-[[2-(2-methylbutan-2-ylamino)-2-oxoethyl]thio]-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-4-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-[[2-(tert-amylamino)-2-keto-ethyl]thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NC(=O)NC(=C1C(=O)O)C

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NC(=O)NC(=C1C(=O)O)C

InChI

InChI=1S/C13H19N3O4S/c1-5-13(3,4)16-8(17)6-21-10-9(11(18)19)7(2)14-12(20)15-10/h5-6H2,1-4H3,(H,16,17)(H,18,19)(H,14,15,20)