ethyl 5-methyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2,4-dioxo-3-prop-2-ynyl-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2,4-dioxo-3-prop-2-ynyl-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2,4-dioxo-3-prop-2-ynyl-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,4-diketo-5-methyl-3-propargyl-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C13H12N2O4S MolecularWeight: 292.31038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CC#C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CC#C)C

InChI

InChI=1S/C13H12N2O4S/c1-4-6-15-11(16)8-7(3)9(12(17)19-5-2)20-10(8)14-13(15)18/h1H,5-6H2,2-3H3,(H,14,18)