(4-cyanophenyl) 3-ethyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (4-cyanophenyl) 3-ethyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (4-cyanophenyl) 3-ethyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-ethyl-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-ethyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-ethyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (4-cyanophenyl) ester Formula: C17H13N3O3S MolecularWeight: 339.36842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C17H13N3O3S/c1-3-20-9-19-15-13(16(20)21)10(2)14(24-15)17(22)23-12-6-4-11(8-18)5-7-12/h4-7,9H,3H2,1-2H3