5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-keto-3-[2-keto-2-(propylamino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C13H15N3O4S MolecularWeight: 309.3409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)O)C

Isomeric SMILES

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)O)C

InChI

InChI=1S/C13H15N3O4S/c1-3-4-14-8(17)5-16-6-15-11-9(12(16)18)7(2)10(21-11)13(19)20/h6H,3-5H2,1-2H3,(H,14,17)(H,19,20)