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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-(2-oxidanylidenepropyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-acetonyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(2-oxopropyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-(2-oxopropyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-acetonyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)C)C

InChI

InChI=1S/C13H14N2O4S/c1-4-19-13(18)10-8(3)9-11(20-10)14-6-15(12(9)17)5-7(2)16/h6H,4-5H2,1-3H3