5-methyl-4-oxidanylidene-2-(thiophen-3-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-4-oxidanylidene-2-(thiophen-3-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-4-oxo-2-(3-thienylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-oxo-2-(3-thiophenylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 5-methyl-4-oxo-2-(thiophen-3-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-keto-5-methyl-2-(3-thenyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C13H10N2O3S2 MolecularWeight: 306.3601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CSC=C3)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CSC=C3)C(=O)O

InChI

InChI=1S/C13H10N2O3S2/c1-6-9-11(16)14-8(4-7-2-3-19-5-7)15-12(9)20-10(6)13(17)18/h2-3,5H,4H2,1H3,(H,17,18)(H,14,15,16)