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

Systemtic Name: 4-[1-(butylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-(butylamino)-1-methyl-2-oxo-ethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-[[1-(butylamino)-1-oxopropan-2-yl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-[1-(butylamino)-1-oxopropan-2-yl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-[[2-(butylamino)-2-keto-1-methyl-ethyl]thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C13H19N3O4S MolecularWeight: 313.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)SC1=NC(=O)NC(=C1C(=O)O)C

Isomeric SMILES

CCCCNC(=O)C(C)SC1=NC(=O)NC(=C1C(=O)O)C

InChI

InChI=1S/C13H19N3O4S/c1-4-5-6-14-10(17)8(3)21-11-9(12(18)19)7(2)15-13(20)16-11/h8H,4-6H2,1-3H3,(H,14,17)(H,18,19)(H,15,16,20)