2-phenoxyethyl 5-methyl-4-oxidanylidene-3-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-phenoxyethyl 5-methyl-4-oxidanylidene-3-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 3-(2-benzyloxy-1-methyl-2-oxo-ethyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(1-oxo-1-phenylmethoxypropan-2-yl)-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-methyl-4-oxo-3-(1-oxo-1-phenylmethoxypropan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(2-benzoxy-2-keto-1-methyl-ethyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C26H24N2O6S MolecularWeight: 492.54356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)OCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)OCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O6S/c1-17-21-23(35-22(17)26(31)33-14-13-32-20-11-7-4-8-12-20)27-16-28(24(21)29)18(2)25(30)34-15-19-9-5-3-6-10-19/h3-12,16,18H,13-15H2,1-2H3