ethyl 2-(4-chlorophenyl)-3-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-4-oxidanylidene-thieno[3,4-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)-3-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-4-oxidanylidene-thieno[3,4-d]pyrimidine-7-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-3-(2-ethoxy-2-oxo-ethyl)-5-methyl-4-oxo-thieno[3,4-d]pyrimidine-7-carboxylate CAS Name: 2-(4-chlorophenyl)-3-(2-ethoxy-2-oxoethyl)-5-methyl-4-oxo-7-thieno[3,4-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-3-(2-ethoxy-2-oxoethyl)-5-methyl-4-oxothieno[3,4-d]pyrimidine-7-carboxylate Traditional Name: 2-(4-chlorophenyl)-3-(2-ethoxy-2-keto-ethyl)-4-keto-5-methyl-thieno[3,4-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C20H19ClN2O5S MolecularWeight: 434.89326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=NC2=C(SC(=C2C1=O)C)C(=O)OCC)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CN1C(=NC2=C(SC(=C2C1=O)C)C(=O)OCC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O5S/c1-4-27-14(24)10-23-18(12-6-8-13(21)9-7-12)22-16-15(19(23)25)11(3)29-17(16)20(26)28-5-2/h6-9H,4-5,10H2,1-3H3