(5-ethanoyl-2-ethoxy-phenyl)methyl 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)acetic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C21H22N2O5S/c1-5-27-17-7-6-15(13(3)24)8-16(17)10-28-18(25)9-23-11-22-20-19(21(23)26)12(2)14(4)29-20/h6-8,11H,5,9-10H2,1-4H3