ethyl 5-methyl-4-oxidanylidene-3-(1-oxidanylidene-1-propoxy-butan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-(1-oxidanylidene-1-propoxy-butan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-3-(1-propoxycarbonylpropyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(1-oxo-1-propoxybutan-2-yl)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-(1-oxo-1-propoxybutan-2-yl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(1-propoxycarbonylpropyl)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CC)N1C=NC2=C(C1=O)C(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCCOC(=O)C(CC)N1C=NC2=C(C1=O)C(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C17H22N2O5S/c1-5-8-24-16(21)11(6-2)19-9-18-14-12(15(19)20)10(4)13(25-14)17(22)23-7-3/h9,11H,5-8H2,1-4H3