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

Systemtic Name: (phenylmethyl) 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(2-phenoxyethoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenoxyethoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(2-phenoxyethoxy)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenoxyethoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(2-phenoxyethoxy)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C25H22N2O6S MolecularWeight: 478.51698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCCOC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCCOC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O6S/c1-17-21-23(34-22(17)25(30)33-15-18-8-4-2-5-9-18)26-16-27(24(21)29)14-20(28)32-13-12-31-19-10-6-3-7-11-19/h2-11,16H,12-15H2,1H3