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

Systemtic Name: (phenylmethyl) 5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-propan-2-yloxy-ethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 3-(2-isopropoxy-2-oxo-ethyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(2-oxo-2-propan-2-yloxyethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-4-oxo-3-(2-oxo-2-propan-2-yloxyethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(2-isopropoxy-2-keto-ethyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OC(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OC(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O5S/c1-12(2)27-15(23)9-22-11-21-18-16(19(22)24)13(3)17(28-18)20(25)26-10-14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3