6-methyl-4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-4-(2-morpholino-2-oxo-ethyl)sulfanyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-4-[[2-(4-morpholinyl)-2-oxoethyl]thio]-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-4-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-4-[(2-keto-2-morpholino-ethyl)thio]-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C12H15N3O5S MolecularWeight: 313.3296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)N2CCOCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)N2CCOCC2)C(=O)O

InChI

InChI=1S/C12H15N3O5S/c1-7-9(11(17)18)10(14-12(19)13-7)21-6-8(16)15-2-4-20-5-3-15/h2-6H2,1H3,(H,17,18)(H,13,14,19)