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

Systemtic Name: ethyl 3-[(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(3-acetyl-2,4,6-trimethyl-phenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(3-acetyl-2,4,6-trimethylphenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-acetyl-2,4,6-trimethylphenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(3-acetyl-2,4,6-trimethyl-benzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=C(C(=C3C)C(=O)C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=C(C(=C3C)C(=O)C)C)C)C

InChI

InChI=1S/C22H24N2O4S/c1-7-28-22(27)19-14(5)18-20(29-19)23-10-24(21(18)26)9-16-11(2)8-12(3)17(13(16)4)15(6)25/h8,10H,7,9H2,1-6H3